#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d1g s LYS 2 N 0.00 0.81 -0.01 2.12 2.20 -0.57 -1.59 119.74 122.71 3d1g s LYS 2 Ca 0.00 0.46 -0.28 0.00 -0.36 0.00 0.00 55.97 55.79 3d1g s LYS 2 Cb 0.00 0.39 0.09 0.00 -1.51 0.00 0.00 37.83 36.80 3d1g s LYS 2 CO 0.00 -0.18 0.78 -0.59 -0.36 0.00 0.00 175.35 175.00 3d1g s PHE 3 N -0.48 -0.48 -0.07 4.03 -0.71 -0.31 -0.63 117.98 119.33 3d1g s PHE 3 Ca -0.06 0.56 -0.00 0.00 -1.04 0.00 0.00 56.93 56.39 3d1g s PHE 3 Cb -0.03 0.49 0.03 0.00 -1.21 0.00 0.00 43.02 42.30 3d1g s PHE 3 CO 0.05 -0.60 -0.02 0.99 -1.34 0.00 0.00 175.22 174.29 3d1g s THR 4 N -2.38 0.52 0.02 -4.49 2.01 -1.26 -0.50 115.64 109.56 3d1g s THR 4 Ca -0.02 -0.01 -0.07 0.00 0.31 0.00 0.00 61.69 61.90 3d1g s THR 4 Cb -0.01 -0.62 -0.00 0.00 0.01 0.00 0.00 72.50 71.88 3d1g s THR 4 CO -0.03 0.27 0.14 0.54 -0.69 0.00 0.00 174.62 174.84 3d1g s VAL 5 N 1.60 0.10 0.32 3.82 0.11 -0.72 -4.49 120.40 121.14 3d1g s VAL 5 Ca -0.00 -0.84 -0.29 0.00 -2.93 0.00 0.00 61.98 57.92 3d1g s VAL 5 Cb -0.13 -0.64 -0.10 0.00 -1.53 0.00 0.00 36.38 33.97 3d1g s VAL 5 CO -0.04 -0.46 1.41 -1.61 -3.33 0.00 0.00 175.10 171.07 3d1g s GLU 6 N -1.92 4.25 0.27 1.54 0.41 -1.26 -0.82 118.70 121.16 3d1g s GLU 6 Ca -0.10 2.36 -0.00 0.00 -0.41 0.00 0.00 54.97 56.81 3d1g s GLU 6 Cb -0.05 -3.05 0.55 0.00 -1.78 0.00 0.00 34.13 29.80 3d1g s GLU 6 CO -0.01 -0.38 1.77 -0.09 -0.49 0.00 0.00 175.26 176.06 3d1g h ARG 7 N 3.87 0.64 -0.81 1.61 2.43 -0.96 -1.62 114.38 119.54 3d1g h ARG 7 Ca -0.48 -0.04 0.20 0.00 -0.81 0.00 0.00 59.98 58.84 3d1g h ARG 7 Cb 1.23 -0.14 -0.05 0.00 -0.42 0.00 0.00 29.97 30.58 3d1g h ARG 7 CO 0.70 0.42 0.55 1.49 -1.51 0.00 0.00 179.97 181.62 3d1g h GLU 8 N 0.66 0.25 -0.00 0.20 4.57 -1.91 -0.07 114.58 118.28 3d1g h GLU 8 Ca 0.48 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.64 3d1g h GLU 8 Cb 0.67 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.20 3d1g h GLU 8 CO -0.36 0.17 -0.06 0.72 -1.18 0.00 0.00 179.01 178.30 3d1g n HIS 9 N -4.43 0.00 -0.03 0.92 8.25 -0.61 -3.72 115.22 115.61 3d1g n HIS 9 Ca 0.17 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.68 3d1g n HIS 9 Cb 0.70 -0.44 -0.14 0.00 1.12 0.00 0.00 29.99 31.24 3d1g n HIS 9 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 3d1g n LEU 10 N -1.46 0.00 0.17 2.41 7.94 -0.07 -4.62 117.00 121.38 3d1g n LEU 10 Ca 0.08 0.00 -0.15 0.00 -1.11 0.00 0.00 56.01 54.83 3d1g n LEU 10 Cb 0.33 0.09 -0.08 0.00 0.53 0.00 0.00 43.42 44.29 3d1g n LEU 10 CO 0.27 0.09 0.52 -0.07 -1.11 0.00 0.00 177.39 177.09 3d1g h LEU 11 N 0.00 -1.25 -0.11 -1.96 -0.00 -1.56 -1.08 115.31 109.35 3d1g h LEU 11 Ca -0.10 0.12 -0.00 0.00 -0.00 0.00 0.00 57.88 57.89 3d1g h LEU 11 Cb 1.10 0.44 -0.01 0.00 -0.00 0.00 0.00 40.66 42.20 3d1g h LEU 11 CO 0.01 -0.52 0.07 0.50 -0.00 0.00 0.00 178.44 178.50 3d1g h LYS 12 N -0.75 0.15 -0.47 1.13 3.64 -1.84 -2.26 116.57 116.17 3d1g h LYS 12 Ca -0.03 -0.01 0.08 0.00 -1.27 0.00 0.00 60.65 59.42 3d1g h LYS 12 Cb 0.69 -0.03 -0.07 0.00 -0.41 0.00 0.00 32.23 32.41 3d1g h LYS 12 CO -0.14 0.13 0.08 -1.35 -2.27 0.00 0.00 179.45 175.90 3d1g h PRO 13 N 0.12 0.20 -0.62 1.90 0.11 -1.80 -1.26 132.00 130.64 3d1g h PRO 13 Ca 0.04 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.12 3d1g h PRO 13 Cb 0.02 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 31.06 3d1g h PRO 13 CO -0.01 0.13 0.33 -0.07 -0.21 0.00 0.00 178.00 178.18 3d1g h LEU 14 N 0.21 0.77 -0.35 2.35 3.38 -1.06 -1.75 115.31 118.85 3d1g h LEU 14 Ca 0.23 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 58.10 3d1g h LEU 14 Cb 0.31 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 3d1g h LEU 14 CO -0.32 0.63 0.04 1.56 0.09 0.00 0.00 178.44 180.44 3d1g h GLN 15 N 0.87 0.59 -0.53 1.13 4.20 -0.75 -2.26 115.11 118.36 3d1g h GLN 15 Ca 0.22 -0.17 -0.09 0.00 0.06 0.00 0.00 58.65 58.68 3d1g h GLN 15 Cb 0.04 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.74 3d1g h GLN 15 CO -0.03 0.68 -0.01 1.96 -0.67 0.00 0.00 178.83 180.75 3d1g h GLN 16 N 0.42 0.95 0.00 1.46 1.08 -0.86 -3.07 115.11 115.09 3d1g h GLN 16 Ca 0.10 -0.31 0.00 0.00 -1.45 0.00 0.00 58.65 57.00 3d1g h GLN 16 Cb 0.38 -0.08 0.00 0.00 -0.05 0.00 0.00 27.48 27.73 3d1g h GLN 16 CO 0.01 0.97 -0.07 1.33 -0.95 0.00 0.00 178.83 180.12 3d1g n VAL 17 N -4.27 0.50 1.01 -0.54 0.24 -0.69 -3.19 118.33 111.39 3d1g n VAL 17 Ca 0.01 -0.25 0.12 0.00 -2.04 0.00 0.00 64.34 62.19 3d1g n VAL 17 Cb 0.33 -0.52 0.32 0.00 -1.47 0.00 0.00 33.84 32.51 3d1g n VAL 17 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 3d1g n SER 18 N -2.16 0.42 -0.02 -1.34 7.64 -0.85 -4.16 113.62 113.14 3d1g n SER 18 Ca 0.05 -0.13 -0.12 0.00 1.01 0.00 0.00 58.87 59.69 3d1g n SER 18 Cb 0.42 0.11 -0.06 0.00 -1.01 0.00 0.00 64.21 63.67 3d1g n SER 18 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 3d1g h GLY 19 N 5.00 0.18 1.83 0.23 0.00 -1.50 -2.94 103.07 105.88 3d1g h GLY 19 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.22 3d1g h GLY 19 CO 0.00 0.10 0.00 -1.55 0.00 0.00 0.00 176.54 175.09 3d1g n PRO 20 N -4.87 0.03 -3.68 4.80 -0.04 -1.26 -4.63 135.00 125.34 3d1g n PRO 20 Ca -0.06 0.35 -0.37 0.00 -0.04 0.00 0.00 63.50 63.39 3d1g n PRO 20 Cb 0.15 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.05 3d1g n PRO 20 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3d1g s LEU 21 N -2.83 4.34 0.00 1.53 1.02 -1.11 -4.54 118.68 117.09 3d1g s LEU 21 Ca 0.03 0.56 0.00 0.00 0.02 0.00 0.00 54.13 54.74 3d1g s LEU 21 Cb 0.03 -2.27 0.00 0.00 0.02 0.00 0.00 46.19 43.97 3d1g s LEU 21 CO 0.08 0.28 0.00 0.61 0.02 0.00 0.00 176.35 177.33 3d1g n GLY 22 N 2.53 2.74 3.50 -3.19 0.00 -1.26 -4.97 105.19 104.54 3d1g n GLY 22 Ca -0.16 -1.92 -0.39 0.00 0.00 0.00 0.00 46.02 43.55 3d1g n GLY 22 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d1g n GLY 23 N 5.00 2.36 2.96 -0.02 0.00 -1.26 -4.56 105.19 109.68 3d1g n GLY 23 Ca 0.00 -1.29 -0.01 0.00 0.00 0.00 0.00 46.02 44.72 3d1g n GLY 23 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3d1g n ARG 24 N 8.15 -1.95 -0.49 1.61 0.63 -1.26 -4.97 116.66 118.39 3d1g n ARG 24 Ca 0.48 1.81 -0.30 0.00 -0.92 0.00 0.00 57.85 58.93 3d1g n ARG 24 Cb 0.45 -3.29 0.28 0.00 0.45 0.00 0.00 32.46 30.35 3d1g n ARG 24 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 3d1g s PRO 25 N -1.40 -2.34 0.12 -0.14 0.04 -1.26 -4.94 135.00 125.07 3d1g s PRO 25 Ca 0.02 0.26 -0.30 0.00 0.04 0.00 0.00 61.00 61.03 3d1g s PRO 25 Cb -0.00 -1.43 -0.09 0.00 0.04 0.00 0.00 34.50 33.02 3d1g s PRO 25 CO 0.43 -4.52 1.60 0.00 0.04 0.00 0.00 177.00 174.55 3d1g h THR 26 N -3.17 0.21 -3.30 1.26 1.03 -2.00 -3.39 112.91 103.55 3d1g h THR 26 Ca -0.48 0.00 -0.58 0.00 -0.01 0.00 0.00 66.41 65.34 3d1g h THR 26 Cb 1.34 0.21 -0.07 0.00 -1.07 0.00 0.00 68.15 68.56 3d1g h THR 26 CO 0.34 0.00 0.40 -0.76 -0.01 0.00 0.00 175.52 175.50 3d1g s LEU 27 N -10.30 4.17 0.28 0.00 1.43 -1.26 -4.96 118.68 108.04 3d1g s LEU 27 Ca -0.16 1.18 0.01 0.00 -1.03 0.00 0.00 54.13 54.13 3d1g s LEU 27 Cb 0.08 -3.24 0.62 0.00 0.03 0.00 0.00 46.19 43.68 3d1g s LEU 27 CO 0.64 -0.41 1.74 -0.65 0.23 0.00 0.00 176.35 177.89 3d1g h PRO 28 N 7.35 0.53 -0.68 1.29 0.11 -1.98 -1.83 132.00 136.79 3d1g h PRO 28 Ca -0.29 -0.03 0.14 0.00 0.11 0.00 0.00 66.00 65.93 3d1g h PRO 28 Cb 1.13 -0.12 -0.04 0.00 0.11 0.00 0.00 31.00 32.08 3d1g h PRO 28 CO 0.84 0.35 0.46 0.97 -0.21 0.00 0.00 178.00 180.41 3d1g h ILE 29 N 0.54 0.81 0.00 4.15 6.09 -1.94 0.26 117.51 127.42 3d1g h ILE 29 Ca 0.51 -0.12 0.00 0.00 -1.37 0.00 0.00 64.86 63.88 3d1g h ILE 29 Cb 0.83 0.44 0.00 0.00 0.47 0.00 0.00 36.82 38.56 3d1g h ILE 29 CO -0.43 0.06 0.00 -0.07 -3.07 0.00 0.00 178.15 174.64 3d1g h LEU 30 N 0.35 0.00 -0.61 2.19 3.38 -1.64 -1.85 115.31 117.13 3d1g h LEU 30 Ca 0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.30 3d1g h LEU 30 Cb 0.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.54 3d1g h LEU 30 CO -0.09 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.05 3d1g n GLY 31 N -0.14 -0.35 3.77 0.83 0.00 0.08 -4.71 105.19 104.66 3d1g n GLY 31 Ca 0.01 -0.34 -0.22 0.00 0.00 0.00 0.00 46.02 45.47 3d1g n GLY 31 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3d1g s ASN 32 N -1.90 5.23 -0.10 1.61 -0.87 -0.70 -1.18 114.94 117.02 3d1g s ASN 32 Ca 0.39 -0.37 -0.02 0.00 -1.57 0.00 0.00 52.86 51.29 3d1g s ASN 32 Cb 0.20 -1.24 -0.03 0.00 -0.02 0.00 0.00 41.25 40.16 3d1g s ASN 32 CO 0.32 -0.02 0.00 -0.76 -2.57 0.00 0.00 177.10 174.07 3d1g s LEU 33 N -3.77 3.55 -0.19 0.60 1.43 0.78 -4.71 118.68 116.37 3d1g s LEU 33 Ca 0.32 0.10 -0.21 0.00 -1.03 0.00 0.00 54.13 53.32 3d1g s LEU 33 Cb -0.07 -1.82 -0.03 0.00 0.03 0.00 0.00 46.19 44.30 3d1g s LEU 33 CO 0.23 0.34 0.63 -0.22 0.23 0.00 0.00 176.35 177.56 3d1g s LEU 34 N -0.62 4.16 -0.14 1.79 2.96 0.25 -1.99 118.68 125.09 3d1g s LEU 34 Ca 0.10 0.86 -0.02 0.00 -0.22 0.00 0.00 54.13 54.85 3d1g s LEU 34 Cb -0.12 -2.90 -0.02 0.00 0.50 0.00 0.00 46.19 43.65 3d1g s LEU 34 CO 0.02 -0.26 -0.09 -0.76 -1.32 0.00 0.00 176.35 173.94 3d1g s LEU 35 N 1.82 2.96 -0.03 -0.68 1.43 0.32 -1.04 118.68 123.45 3d1g s LEU 35 Ca 0.29 -0.23 0.00 0.00 -1.03 0.00 0.00 54.13 53.17 3d1g s LEU 35 Cb -0.16 -1.69 0.03 0.00 0.03 0.00 0.00 46.19 44.40 3d1g s LEU 35 CO 0.11 0.18 0.00 -1.10 0.23 0.00 0.00 176.35 175.77 3d1g s GLN 36 N 0.28 0.32 -0.22 1.70 -0.21 -0.43 -1.72 119.66 119.38 3d1g s GLN 36 Ca -0.07 0.10 -0.04 0.00 0.02 0.00 0.00 55.36 55.37 3d1g s GLN 36 Cb -0.15 -0.55 -0.01 0.00 1.00 0.00 0.00 33.01 33.31 3d1g s GLN 36 CO 0.04 -0.17 -0.04 0.08 -2.12 0.00 0.00 175.29 173.09 3d1g s VAL 37 N 1.21 3.40 -0.27 1.09 1.01 0.53 -0.30 120.40 127.07 3d1g s VAL 37 Ca -0.07 -0.48 -0.24 0.00 0.00 0.00 0.00 61.98 61.19 3d1g s VAL 37 Cb -0.13 -2.55 0.08 0.00 0.00 0.00 0.00 36.38 33.78 3d1g s VAL 37 CO -0.02 0.42 0.78 0.00 0.00 0.00 0.00 175.10 176.28 3d1g s ALA 38 N 1.46 -1.84 -1.39 5.51 0.00 -0.58 -1.76 121.76 123.16 3d1g s ALA 38 Ca 0.05 2.04 -0.03 0.00 0.00 0.00 0.00 51.96 54.03 3d1g s ALA 38 Cb -0.14 -1.26 0.02 0.00 0.00 0.00 0.00 23.12 21.73 3d1g s ALA 38 CO -0.03 -0.32 0.63 -3.47 0.00 0.00 0.00 175.76 172.56 3d1g n ASP 39 N 2.77 -1.36 -1.49 0.00 2.03 -1.26 -1.48 116.55 115.77 3d1g n ASP 39 Ca -0.14 -0.90 -0.18 0.00 0.52 0.00 0.00 54.79 54.09 3d1g n ASP 39 Cb 0.56 -3.58 -0.06 0.00 -0.72 0.00 0.00 41.12 37.31 3d1g n ASP 39 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3d1g n GLY 40 N -1.74 1.38 2.97 0.27 0.00 -1.26 -4.98 105.19 101.82 3d1g n GLY 40 Ca -0.25 -0.16 -0.18 0.00 0.00 0.00 0.00 46.02 45.44 3d1g n GLY 40 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d1g s THR 41 N -2.70 0.56 -0.23 2.61 2.01 -0.55 -1.55 115.64 115.79 3d1g s THR 41 Ca 0.00 -0.26 -0.10 0.00 0.31 0.00 0.00 61.69 61.64 3d1g s THR 41 Cb 0.00 -0.49 -0.05 0.00 0.01 0.00 0.00 72.50 71.97 3d1g s THR 41 CO 0.00 0.17 0.13 -0.22 -0.69 0.00 0.00 174.62 174.01 3d1g s LEU 42 N 0.07 4.00 -0.09 4.42 2.96 0.05 -1.53 118.68 128.56 3d1g s LEU 42 Ca -0.01 0.08 0.02 0.00 -0.22 0.00 0.00 54.13 54.01 3d1g s LEU 42 Cb -0.05 -2.06 -0.02 0.00 0.50 0.00 0.00 46.19 44.56 3d1g s LEU 42 CO -0.00 0.09 -0.14 -0.44 -1.32 0.00 0.00 176.35 174.54 3d1g s SER 43 N 0.91 4.00 -0.10 3.68 0.01 0.59 -0.05 113.70 122.74 3d1g s SER 43 Ca 0.06 -0.26 0.03 0.00 1.31 0.00 0.00 55.95 57.10 3d1g s SER 43 Cb -0.13 -1.21 -0.00 0.00 0.21 0.00 0.00 66.02 64.89 3d1g s SER 43 CO 0.03 0.26 -0.22 -0.76 0.41 0.00 0.00 173.24 172.96 3d1g s LEU 44 N -0.22 2.18 -0.02 2.44 1.02 0.15 -1.32 118.68 122.92 3d1g s LEU 44 Ca 0.01 -0.53 0.04 0.00 0.02 0.00 0.00 54.13 53.67 3d1g s LEU 44 Cb -0.13 -1.44 -0.01 0.00 0.02 0.00 0.00 46.19 44.63 3d1g s LEU 44 CO 0.03 0.16 -0.12 -0.89 0.02 0.00 0.00 176.35 175.55 3d1g s THR 45 N 0.34 0.97 0.04 5.49 2.01 -0.21 -0.88 115.64 123.40 3d1g s THR 45 Ca -0.18 -0.51 0.05 0.00 0.31 0.00 0.00 61.69 61.36 3d1g s THR 45 Cb -0.18 -0.82 -0.02 0.00 0.01 0.00 0.00 72.50 71.49 3d1g s THR 45 CO 0.09 0.28 -0.13 -0.83 -0.69 0.00 0.00 174.62 173.33 3d1g s GLY 46 N -0.16 0.76 0.17 4.40 0.00 -0.70 -0.58 107.32 111.20 3d1g s GLY 46 Ca 0.02 -0.81 -0.18 0.00 0.00 0.00 0.00 44.72 43.75 3d1g s GLY 46 CO -0.00 -0.80 0.49 -1.08 0.00 0.00 0.00 173.10 171.72 3d1g s THR 47 N -0.88 0.04 -0.03 0.90 -1.32 -1.26 -1.32 115.64 111.76 3d1g s THR 47 Ca 0.01 -0.64 0.04 0.00 -1.21 0.00 0.00 61.69 59.89 3d1g s THR 47 Cb -0.08 -1.40 0.06 0.00 -1.51 0.00 0.00 72.50 69.57 3d1g s THR 47 CO 0.01 -0.16 0.96 -0.90 -2.21 0.00 0.00 174.62 172.32 3d1g n ASP 48 N -0.31 0.61 0.00 8.08 5.75 -1.09 -4.77 116.55 124.82 3d1g n ASP 48 Ca -0.12 -2.10 0.00 0.00 -0.01 0.00 0.00 54.79 52.56 3d1g n ASP 48 Cb 0.63 -0.21 0.00 0.00 -1.03 0.00 0.00 41.12 40.51 3d1g n ASP 48 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 3d1g n LEU 49 N -0.34 0.00 0.08 -2.12 4.77 -1.26 -4.68 117.00 113.45 3d1g n LEU 49 Ca 0.03 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.82 3d1g n LEU 49 Cb 0.64 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.58 3d1g n LEU 49 CO 0.00 0.00 -0.33 -0.33 -1.33 0.00 0.00 177.39 175.40 3d1g h GLU 50 N 0.00 0.33 -4.27 3.23 4.39 -1.96 -3.48 114.58 112.82 3d1g h GLU 50 Ca 0.00 -0.57 -0.16 0.00 0.34 0.00 0.00 59.36 58.97 3d1g h GLU 50 Cb 0.00 0.21 -0.14 0.00 -0.10 0.00 0.00 28.75 28.72 3d1g h GLU 50 CO 0.00 1.23 -0.57 0.00 -1.16 0.00 0.00 179.01 178.51 3d1g s MET 51 N -2.61 0.94 -0.01 2.33 0.23 -1.26 -1.78 119.30 117.14 3d1g s MET 51 Ca -0.10 -1.35 -0.02 0.00 -1.03 0.00 0.00 55.69 53.19 3d1g s MET 51 Cb 0.06 0.27 -0.00 0.00 -1.53 0.00 0.00 34.83 33.63 3d1g s MET 51 CO 0.87 -0.28 0.04 -2.00 -2.03 0.00 0.00 175.02 171.62 3d1g s GLU 52 N -4.01 0.19 -0.09 3.16 2.12 0.80 -2.67 118.70 118.20 3d1g s GLU 52 Ca 0.20 -0.19 0.01 0.00 0.36 0.00 0.00 54.97 55.36 3d1g s GLU 52 Cb 0.07 0.08 0.02 0.00 0.26 0.00 0.00 34.13 34.55 3d1g s GLU 52 CO -0.00 -0.04 -0.11 -1.64 -0.54 0.00 0.00 175.26 172.93 3d1g s MET 53 N -0.60 1.73 -0.09 4.30 -1.94 -0.44 -0.68 119.30 121.59 3d1g s MET 53 Ca -0.07 -0.38 0.04 0.00 -1.71 0.00 0.00 55.69 53.57 3d1g s MET 53 Cb -0.04 -1.56 -0.00 0.00 2.01 0.00 0.00 34.83 35.24 3d1g s MET 53 CO -0.00 -0.10 -0.23 0.08 -0.01 0.00 0.00 175.02 174.76 3d1g s VAL 54 N 1.11 1.93 -0.04 -6.03 1.01 0.00 -1.73 120.40 116.65 3d1g s VAL 54 Ca -0.06 -0.96 0.06 0.00 0.00 0.00 0.00 61.98 61.02 3d1g s VAL 54 Cb -0.14 -1.67 -0.01 0.00 0.00 0.00 0.00 36.38 34.56 3d1g s VAL 54 CO -0.02 0.53 -0.21 0.00 0.00 0.00 0.00 175.10 175.40 3d1g s ALA 55 N 0.28 1.81 -0.05 5.51 0.00 -0.06 -0.80 121.76 128.46 3d1g s ALA 55 Ca -0.15 -0.88 0.04 0.00 0.00 0.00 0.00 51.96 50.97 3d1g s ALA 55 Cb -0.17 -0.55 -0.03 0.00 0.00 0.00 0.00 23.12 22.38 3d1g s ALA 55 CO 0.07 0.37 -0.15 1.03 0.00 0.00 0.00 175.76 177.08 3d1g s ARG 56 N -0.17 2.48 -0.10 0.00 0.52 -0.74 -0.67 118.95 120.27 3d1g s ARG 56 Ca -0.01 -0.71 0.00 0.00 -0.52 0.00 0.00 55.73 54.50 3d1g s ARG 56 Cb -0.11 -2.36 0.02 0.00 0.52 0.00 0.00 34.95 33.01 3d1g s ARG 56 CO 0.02 0.62 -0.08 0.08 0.02 0.00 0.00 175.30 175.96 3d1g s VAL 57 N -0.73 1.00 0.16 3.52 1.01 0.92 -4.87 120.40 121.40 3d1g s VAL 57 Ca 0.11 -0.31 -0.31 0.00 0.00 0.00 0.00 61.98 61.48 3d1g s VAL 57 Cb -0.11 -0.99 -0.09 0.00 0.00 0.00 0.00 36.38 35.19 3d1g s VAL 57 CO 0.01 0.35 1.42 0.00 0.00 0.00 0.00 175.10 176.88 3d1g s ALA 58 N 1.41 3.63 -0.46 5.51 0.00 -1.26 -0.77 121.76 129.81 3d1g s ALA 58 Ca -0.01 1.20 -0.13 0.00 0.00 0.00 0.00 51.96 53.02 3d1g s ALA 58 Cb -0.13 -3.55 0.08 0.00 0.00 0.00 0.00 23.12 19.52 3d1g s ALA 58 CO -0.05 -0.65 0.36 -0.51 0.00 0.00 0.00 175.76 174.91 3d1g s LEU 59 N 0.72 5.52 0.02 0.00 1.43 -0.59 -4.90 118.68 120.88 3d1g s LEU 59 Ca 0.64 -1.46 -0.00 0.00 -1.03 0.00 0.00 54.13 52.28 3d1g s LEU 59 Cb -0.39 -2.11 -0.26 0.00 0.03 0.00 0.00 46.19 43.46 3d1g s LEU 59 CO 0.33 -0.63 0.92 -0.37 0.23 0.00 0.00 176.35 176.83 3d1g h VAL 60 N 5.90 1.22 -3.86 -1.59 -1.51 -1.88 -3.46 116.25 111.07 3d1g h VAL 60 Ca -0.26 -2.89 -0.50 0.00 -1.23 0.00 0.00 66.70 61.82 3d1g h VAL 60 Cb 1.10 2.75 0.04 0.00 -2.13 0.00 0.00 31.29 33.05 3d1g h VAL 60 CO 0.85 0.81 0.22 -1.10 -1.23 0.00 0.00 177.57 177.13 3d1g s GLN 61 N -2.63 3.57 0.25 5.19 -0.21 -1.26 -5.00 119.66 119.56 3d1g s GLN 61 Ca -0.07 0.41 -0.28 0.00 0.02 0.00 0.00 55.36 55.43 3d1g s GLN 61 Cb 0.07 -2.27 -0.15 0.00 1.00 0.00 0.00 33.01 31.67 3d1g s GLN 61 CO 0.85 -0.34 0.86 -2.30 -2.12 0.00 0.00 175.29 172.24 3d1g n PRO 62 N -2.43 0.89 -3.93 2.91 -0.02 -1.26 -4.78 135.00 126.38 3d1g n PRO 62 Ca 0.03 0.31 -0.09 0.00 -2.02 0.00 0.00 63.50 61.72 3d1g n PRO 62 Cb 0.55 -1.57 -0.06 0.00 -0.02 0.00 0.00 33.50 32.40 3d1g n PRO 62 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 3d1g s HIS 63 N -0.97 0.28 -0.04 6.00 -3.43 -1.26 -4.08 115.29 111.80 3d1g s HIS 63 Ca 0.62 -0.64 0.01 0.00 -0.80 0.00 0.00 55.06 54.25 3d1g s HIS 63 Cb -0.79 0.13 0.02 0.00 -1.43 0.00 0.00 32.58 30.51 3d1g s HIS 63 CO 0.58 -0.87 -0.05 -1.21 -2.00 0.00 0.00 174.74 171.18 3d1g s GLU 64 N -3.97 0.87 0.82 -0.38 2.02 0.20 -4.94 118.70 113.31 3d1g s GLU 64 Ca 0.18 -0.15 -0.13 0.00 0.02 0.00 0.00 54.97 54.89 3d1g s GLU 64 Cb 0.01 -0.84 0.09 0.00 0.10 0.00 0.00 34.13 33.48 3d1g s GLU 64 CO 0.03 -0.04 1.18 -0.35 0.02 0.00 0.00 175.26 176.10 3d1g n PRO 65 N 3.89 0.12 0.00 0.39 -0.04 -1.26 -1.51 135.00 136.59 3d1g n PRO 65 Ca -0.24 0.12 0.00 0.00 -0.04 0.00 0.00 63.50 63.34 3d1g n PRO 65 Cb 0.51 -2.42 0.00 0.00 -0.04 0.00 0.00 33.50 31.56 3d1g n PRO 65 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3d1g n GLY 66 N 0.55 1.78 3.22 0.55 0.00 -0.72 -3.16 105.19 107.41 3d1g n GLY 66 Ca 0.13 -1.56 -0.10 0.00 0.00 0.00 0.00 46.02 44.49 3d1g n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d1g s ALA 67 N -1.77 -0.41 0.11 4.61 0.00 -1.26 -0.34 121.76 122.70 3d1g s ALA 67 Ca 0.00 -0.39 -0.25 0.00 0.00 0.00 0.00 51.96 51.33 3d1g s ALA 67 Cb 0.00 0.44 0.08 0.00 0.00 0.00 0.00 23.12 23.65 3d1g s ALA 67 CO 0.00 -0.48 1.12 -0.08 0.00 0.00 0.00 175.76 176.32 3d1g s THR 68 N -3.39 0.00 0.01 0.00 -1.32 -0.70 -4.64 115.64 105.59 3d1g s THR 68 Ca 0.01 -0.45 0.01 0.00 -1.21 0.00 0.00 61.69 60.05 3d1g s THR 68 Cb 0.02 -2.78 -0.01 0.00 -1.51 0.00 0.00 72.50 68.23 3d1g s THR 68 CO -0.09 0.00 -0.05 0.42 -2.21 0.00 0.00 174.62 172.70 3d1g s THR 69 N -2.23 0.33 0.07 5.08 -4.23 -1.05 -0.52 115.64 113.09 3d1g s THR 69 Ca 0.23 -0.39 0.00 0.00 -1.18 0.00 0.00 61.69 60.35 3d1g s THR 69 Cb -0.01 -0.33 -0.04 0.00 1.34 0.00 0.00 72.50 73.46 3d1g s THR 69 CO 0.03 -0.04 -0.05 0.68 -0.54 0.00 0.00 174.62 174.70 3d1g s VAL 70 N -0.43 0.44 -0.15 2.29 -7.23 -0.84 -2.33 120.40 112.14 3d1g s VAL 70 Ca -0.02 -1.73 -0.37 0.00 -1.81 0.00 0.00 61.98 58.05 3d1g s VAL 70 Cb -0.04 -1.42 -0.14 0.00 0.56 0.00 0.00 36.38 35.35 3d1g s VAL 70 CO -0.00 -0.86 1.76 -2.65 -0.31 0.00 0.00 175.10 173.04 3d1g n PRO 71 N 0.27 1.61 0.25 4.82 -0.02 -1.26 -0.16 135.00 140.52 3d1g n PRO 71 Ca -0.15 0.59 -0.15 0.00 -2.02 0.00 0.00 63.50 61.77 3d1g n PRO 71 Cb 0.60 -2.34 -0.08 0.00 -0.02 0.00 0.00 33.50 31.66 3d1g n PRO 71 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3d1g h ALA 72 N 7.71 -0.61 -0.57 3.55 0.00 -1.43 -2.18 119.26 125.72 3d1g h ALA 72 Ca -0.47 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.24 3d1g h ALA 72 Cb 1.30 0.24 -0.03 0.00 0.00 0.00 0.00 17.79 19.30 3d1g h ALA 72 CO 0.94 -0.78 0.25 -0.09 0.00 0.00 0.00 179.25 179.57 3d1g h ARG 73 N -0.74 0.84 -0.48 0.00 9.65 -1.90 -1.21 114.38 120.53 3d1g h ARG 73 Ca -0.06 -0.14 -0.03 0.00 -1.10 0.00 0.00 59.98 58.64 3d1g h ARG 73 Cb 0.53 -0.14 -0.02 0.00 -1.39 0.00 0.00 29.97 28.95 3d1g h ARG 73 CO 0.10 0.71 0.18 0.87 2.80 0.00 0.00 179.97 184.63 3d1g h LYS 74 N 0.78 0.73 -0.57 0.20 1.57 -1.94 0.11 116.57 117.46 3d1g h LYS 74 Ca 0.19 -0.14 -0.07 0.00 -1.87 0.00 0.00 60.65 58.76 3d1g h LYS 74 Cb 0.17 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 3d1g h LYS 74 CO -0.02 0.67 0.06 0.35 -0.57 0.00 0.00 179.45 179.94 3d1g h PHE 75 N 0.64 1.03 -0.13 -1.35 3.57 -1.27 -0.89 116.94 118.54 3d1g h PHE 75 Ca 0.16 -0.16 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 3d1g h PHE 75 Cb 0.22 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.68 3d1g h PHE 75 CO 0.01 0.91 0.04 0.35 -2.23 0.00 0.00 178.31 177.39 3d1g h PHE 76 N 0.85 0.20 -0.66 0.41 3.57 -0.99 -2.01 116.94 118.31 3d1g h PHE 76 Ca 0.17 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.64 3d1g h PHE 76 Cb 0.46 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.11 3d1g h PHE 76 CO 0.03 0.31 0.37 -0.44 -2.23 0.00 0.00 178.31 176.35 3d1g h ASP 77 N 0.03 0.80 0.05 0.41 3.32 -0.63 -0.34 116.42 120.07 3d1g h ASP 77 Ca 0.04 -0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.03 3d1g h ASP 77 Cb 0.20 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.54 3d1g h ASP 77 CO -0.00 0.64 -0.03 0.40 -1.72 0.00 0.00 179.24 178.53 3d1g h ILE 78 N 0.92 1.06 -0.35 0.35 2.04 -0.98 -0.21 117.51 120.33 3d1g h ILE 78 Ca 0.24 -0.38 -0.01 0.00 1.00 0.00 0.00 64.86 65.71 3d1g h ILE 78 Cb 0.01 1.31 -0.02 0.00 -0.74 0.00 0.00 36.82 37.39 3d1g h ILE 78 CO -0.04 0.10 0.19 0.00 0.00 0.00 0.00 178.15 178.40 3d1g h ARG 80 N 0.44 0.29 0.00 0.00 2.43 -1.05 -2.77 114.38 113.72 3d1g h ARG 80 Ca 0.12 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 3d1g h ARG 80 Cb 0.07 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.58 3d1g h ARG 80 CO -0.02 0.47 0.00 0.41 -1.51 0.00 0.00 179.97 179.32 3d1g n GLY 81 N -0.69 -1.45 3.82 2.80 0.00 -0.10 -4.82 105.19 104.75 3d1g n GLY 81 Ca -0.01 0.03 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 3d1g n GLY 81 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d1g s LEU 82 N -4.40 3.24 0.70 0.99 1.43 -1.05 -5.02 118.68 114.58 3d1g s LEU 82 Ca 0.07 1.66 -0.14 0.00 -1.03 0.00 0.00 54.13 54.69 3d1g s LEU 82 Cb 0.11 -4.50 0.02 0.00 0.03 0.00 0.00 46.19 41.84 3d1g s LEU 82 CO 0.48 -1.34 1.14 -2.16 0.23 0.00 0.00 176.35 174.69 3d1g s PRO 83 N -4.77 2.50 0.30 1.29 0.04 -1.26 -4.94 135.00 128.16 3d1g s PRO 83 Ca 0.59 1.48 -0.29 0.00 0.04 0.00 0.00 61.00 62.83 3d1g s PRO 83 Cb -0.14 -1.90 -0.13 0.00 0.04 0.00 0.00 34.50 32.36 3d1g s PRO 83 CO 0.50 -1.50 1.31 0.39 0.04 0.00 0.00 177.00 177.73 3d1g n GLU 84 N -2.66 2.03 -1.00 4.56 -0.58 -1.26 -1.80 120.64 119.93 3d1g n GLU 84 Ca 0.11 0.72 0.00 0.00 -0.42 0.00 0.00 57.16 57.57 3d1g n GLU 84 Cb 0.52 -2.31 0.00 0.00 -0.57 0.00 0.00 31.44 29.08 3d1g n GLU 84 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3d1g n GLY 85 N 1.34 0.71 3.77 0.62 0.00 -1.26 -5.02 105.19 105.36 3d1g n GLY 85 Ca 0.08 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.74 3d1g n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d1g s ALA 86 N -2.86 2.87 -0.15 4.61 0.00 -0.74 -4.85 121.76 120.63 3d1g s ALA 86 Ca 0.00 0.86 -0.05 0.00 0.00 0.00 0.00 51.96 52.76 3d1g s ALA 86 Cb 0.00 -3.36 -0.04 0.00 0.00 0.00 0.00 23.12 19.73 3d1g s ALA 86 CO 0.00 -0.64 0.04 -1.21 0.00 0.00 0.00 175.76 173.95 3d1g s GLU 87 N -2.94 3.63 -0.23 0.00 2.02 -1.26 -0.26 118.70 119.65 3d1g s GLU 87 Ca 0.67 -0.36 -0.03 0.00 0.02 0.00 0.00 54.97 55.28 3d1g s GLU 87 Cb -0.26 -3.07 0.01 0.00 0.10 0.00 0.00 34.13 30.92 3d1g s GLU 87 CO 0.30 0.44 -0.06 0.42 0.02 0.00 0.00 175.26 176.38 3d1g s ILE 88 N -0.11 3.05 -0.22 -1.63 1.01 -0.00 -4.41 121.20 118.89 3d1g s ILE 88 Ca 0.06 -0.80 -0.10 0.00 0.00 0.00 0.00 60.65 59.81 3d1g s ILE 88 Cb -0.12 -2.47 -0.05 0.00 0.01 0.00 0.00 42.46 39.83 3d1g s ILE 88 CO 0.01 0.31 0.14 0.00 0.00 0.00 0.00 174.94 175.40 3d1g s ALA 89 N 1.39 3.62 -0.03 9.38 0.00 0.11 -1.76 121.76 134.48 3d1g s ALA 89 Ca 0.03 -0.79 0.05 0.00 0.00 0.00 0.00 51.96 51.24 3d1g s ALA 89 Cb -0.15 -2.22 -0.01 0.00 0.00 0.00 0.00 23.12 20.73 3d1g s ALA 89 CO -0.04 -0.02 -0.17 0.08 0.00 0.00 0.00 175.76 175.61 3d1g s VAL 90 N 0.71 1.38 -0.11 0.00 1.01 0.35 -0.55 120.40 123.20 3d1g s VAL 90 Ca 0.07 -0.71 -0.15 0.00 0.00 0.00 0.00 61.98 61.19 3d1g s VAL 90 Cb -0.12 -1.17 0.04 0.00 0.00 0.00 0.00 36.38 35.12 3d1g s VAL 90 CO 0.01 0.40 0.39 0.00 0.00 0.00 0.00 175.10 175.90 3d1g s GLN 91 N -0.14 0.56 0.03 2.72 -2.07 -0.73 -1.16 119.66 118.88 3d1g s GLN 91 Ca 0.01 0.33 -0.24 0.00 -1.82 0.00 0.00 55.36 53.63 3d1g s GLN 91 Cb -0.09 0.26 -0.05 0.00 -1.09 0.00 0.00 33.01 32.04 3d1g s GLN 91 CO 0.01 -0.11 0.74 -1.17 -1.32 0.00 0.00 175.29 173.44 3d1g s LEU 92 N -0.30 4.44 -0.26 2.60 2.96 -0.62 -0.71 118.68 126.79 3d1g s LEU 92 Ca -0.04 1.40 -0.04 0.00 -0.22 0.00 0.00 54.13 55.23 3d1g s LEU 92 Cb -0.03 -3.19 0.09 0.00 0.50 0.00 0.00 46.19 43.56 3d1g s LEU 92 CO 0.02 0.02 0.11 -0.70 -1.32 0.00 0.00 176.35 174.49 3d1g s GLU 93 N -0.04 0.26 7.97 1.98 2.12 0.13 -4.79 118.70 126.33 3d1g s GLU 93 Ca 0.38 -0.51 0.00 0.00 0.36 0.00 0.00 54.97 55.20 3d1g s GLU 93 Cb -0.20 -1.45 0.00 0.00 0.26 0.00 0.00 34.13 32.74 3d1g s GLU 93 CO 0.22 -0.93 0.00 0.41 -0.54 0.00 0.00 175.26 174.42 3d1g n GLY 94 N 5.19 4.08 0.99 -1.50 0.00 -1.26 -0.84 105.19 111.85 3d1g n GLY 94 Ca -0.06 0.06 0.10 0.00 0.00 0.00 0.00 46.02 46.12 3d1g n GLY 94 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3d1g n GLU 95 N 13.89 2.26 -4.29 1.61 -0.58 -1.26 -4.93 120.64 127.34 3d1g n GLU 95 Ca 0.00 -1.93 -0.20 0.00 -0.42 0.00 0.00 57.16 54.60 3d1g n GLU 95 Cb 0.00 -1.45 -0.11 0.00 -0.57 0.00 0.00 31.44 29.31 3d1g n GLU 95 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 3d1g s ARG 96 N -1.39 1.16 -0.19 3.49 0.52 -0.02 -2.70 118.95 119.83 3d1g s ARG 96 Ca 0.37 -1.32 -0.02 0.00 -0.52 0.00 0.00 55.73 54.24 3d1g s ARG 96 Cb 0.20 -1.17 -0.01 0.00 0.52 0.00 0.00 34.95 34.49 3d1g s ARG 96 CO 0.27 0.24 -0.08 1.41 0.02 0.00 0.00 175.30 177.15 3d1g s MET 97 N -2.67 3.37 -0.11 3.54 -2.45 -0.08 0.22 119.30 121.12 3d1g s MET 97 Ca 0.12 -0.65 -0.15 0.00 -1.25 0.00 0.00 55.69 53.76 3d1g s MET 97 Cb -0.06 -2.86 -0.05 0.00 1.25 0.00 0.00 34.83 33.12 3d1g s MET 97 CO 0.05 -0.05 0.38 -0.51 1.05 0.00 0.00 175.02 175.94 3d1g s LEU 98 N 1.05 4.30 -0.14 4.11 1.02 0.12 -1.13 118.68 128.01 3d1g s LEU 98 Ca 0.00 0.71 0.02 0.00 0.02 0.00 0.00 54.13 54.88 3d1g s LEU 98 Cb -0.15 -2.53 0.01 0.00 0.02 0.00 0.00 46.19 43.55 3d1g s LEU 98 CO -0.01 0.11 -0.20 -0.69 0.02 0.00 0.00 176.35 175.59 3d1g s VAL 99 N 0.19 1.91 0.00 -1.59 1.01 0.30 -1.77 120.40 120.44 3d1g s VAL 99 Ca 0.21 -0.87 0.04 0.00 0.00 0.00 0.00 61.98 61.36 3d1g s VAL 99 Cb -0.14 -1.71 -0.01 0.00 0.00 0.00 0.00 36.38 34.52 3d1g s VAL 99 CO 0.08 0.52 -0.12 -0.13 0.00 0.00 0.00 175.10 175.45 3d1g s ARG 100 N 1.00 0.89 -0.29 2.72 0.52 0.29 -0.50 118.95 123.58 3d1g s ARG 100 Ca -0.04 -0.49 -0.13 0.00 -0.52 0.00 0.00 55.73 54.56 3d1g s ARG 100 Cb -0.15 -0.86 0.10 0.00 0.52 0.00 0.00 34.95 34.57 3d1g s ARG 100 CO -0.05 0.23 0.68 0.45 0.02 0.00 0.00 175.30 176.63 3d1g s SER 101 N -0.50 -1.03 1.74 0.23 0.15 -0.70 -0.71 113.70 112.88 3d1g s SER 101 Ca 0.03 1.53 0.00 0.00 0.70 0.00 0.00 55.95 58.21 3d1g s SER 101 Cb -0.05 1.81 0.00 0.00 -1.71 0.00 0.00 66.02 66.07 3d1g s SER 101 CO -0.00 -0.23 0.00 0.61 1.20 0.00 0.00 173.24 174.82 3d1g n GLY 102 N 4.83 3.70 1.50 9.45 0.00 -1.26 -0.25 105.19 123.16 3d1g n GLY 102 Ca -0.16 0.01 -0.12 0.00 0.00 0.00 0.00 46.02 45.75 3d1g n GLY 102 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d1g n ARG 103 N 14.00 2.13 -4.40 1.61 1.74 -1.26 -4.95 116.66 125.53 3d1g n ARG 103 Ca 0.00 -3.28 -0.34 0.00 -0.77 0.00 0.00 57.85 53.47 3d1g n ARG 103 Cb 0.00 -1.95 -0.12 0.00 -1.02 0.00 0.00 32.46 29.37 3d1g n ARG 103 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 3d1g s SER 104 N -2.42 4.84 -0.03 0.55 0.01 0.66 -5.11 113.70 112.20 3d1g s SER 104 Ca 0.49 -0.10 0.02 0.00 1.31 0.00 0.00 55.95 57.66 3d1g s SER 104 Cb 0.43 -1.75 0.01 0.00 0.21 0.00 0.00 66.02 64.92 3d1g s SER 104 CO 0.01 0.19 -0.07 -0.13 0.41 0.00 0.00 173.24 173.65 3d1g s ARG 105 N 0.25 0.84 0.01 12.44 0.52 -1.26 -1.71 118.95 130.04 3d1g s ARG 105 Ca -0.03 -0.24 0.02 0.00 -0.52 0.00 0.00 55.73 54.97 3d1g s ARG 105 Cb -0.14 -0.80 -0.01 0.00 0.52 0.00 0.00 34.95 34.52 3d1g s ARG 105 CO 0.03 0.06 -0.08 -0.06 0.02 0.00 0.00 175.30 175.27 3d1g s PHE 106 N 0.32 0.70 -0.22 -0.53 0.40 0.35 -5.00 117.98 114.00 3d1g s PHE 106 Ca -0.05 -0.24 0.01 0.00 -0.60 0.00 0.00 56.93 56.06 3d1g s PHE 106 Cb -0.09 -0.43 0.05 0.00 0.51 0.00 0.00 43.02 43.06 3d1g s PHE 106 CO 0.00 -0.02 -0.08 0.45 0.70 0.00 0.00 175.22 176.27 3d1g s SER 107 N -0.62 3.61 0.04 1.36 0.15 -1.26 -0.54 113.70 116.44 3d1g s SER 107 Ca -0.01 -1.02 0.02 0.00 0.70 0.00 0.00 55.95 55.64 3d1g s SER 107 Cb -0.05 -1.21 -0.04 0.00 -1.71 0.00 0.00 66.02 63.01 3d1g s SER 107 CO 0.00 -0.19 0.07 -0.76 1.20 0.00 0.00 173.24 173.56 3d1g s LEU 108 N 1.39 3.79 0.70 3.45 1.02 -0.28 -4.91 118.68 123.84 3d1g s LEU 108 Ca -0.04 0.04 -0.13 0.00 0.02 0.00 0.00 54.13 54.03 3d1g s LEU 108 Cb -0.17 -2.36 0.02 0.00 0.02 0.00 0.00 46.19 43.69 3d1g s LEU 108 CO -0.07 0.22 1.09 -0.94 0.02 0.00 0.00 176.35 176.66 3d1g s SER 109 N -2.08 5.02 0.18 2.29 1.04 -1.26 -0.90 113.70 117.99 3d1g s SER 109 Ca 0.26 1.84 0.02 0.00 0.48 0.00 0.00 55.95 58.55 3d1g s SER 109 Cb -0.12 -2.53 -0.05 0.00 0.10 0.00 0.00 66.02 63.42 3d1g s SER 109 CO 0.18 -1.69 0.00 0.42 0.98 0.00 0.00 173.24 173.14 3d1g s THR 110 N -2.69 0.73 -0.01 2.02 -4.23 -1.10 -4.27 115.64 106.10 3d1g s THR 110 Ca 0.63 -1.99 0.02 0.00 -1.18 0.00 0.00 61.69 59.16 3d1g s THR 110 Cb -0.17 -2.17 -0.00 0.00 1.34 0.00 0.00 72.50 71.50 3d1g s THR 110 CO 0.49 -0.44 -0.05 -0.76 -0.54 0.00 0.00 174.62 173.31 3d1g s LEU 111 N -3.20 1.97 0.20 4.79 1.43 -0.99 -5.00 118.68 117.89 3d1g s LEU 111 Ca 0.25 -0.10 -0.32 0.00 -1.03 0.00 0.00 54.13 52.93 3d1g s LEU 111 Cb 0.06 -0.28 -0.14 0.00 0.03 0.00 0.00 46.19 45.85 3d1g s LEU 111 CO 0.05 0.06 1.32 -2.65 0.23 0.00 0.00 176.35 175.36 3d1g n PRO 112 N 3.01 1.67 0.27 1.29 -0.02 -1.26 -2.53 135.00 137.43 3d1g n PRO 112 Ca -0.14 0.59 0.12 0.00 -2.02 0.00 0.00 63.50 62.06 3d1g n PRO 112 Cb 0.58 -2.20 0.76 0.00 -0.02 0.00 0.00 33.50 32.62 3d1g n PRO 112 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3d1g h ALA 113 N 4.03 1.51 0.00 3.55 0.00 -1.84 -0.81 119.26 125.69 3d1g h ALA 113 Ca -0.44 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3d1g h ALA 113 Cb 1.30 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.08 3d1g h ALA 113 CO 0.75 0.09 0.00 0.00 0.00 0.00 0.00 179.25 180.09 3d1g h ALA 114 N 1.93 1.00 0.00 0.00 0.00 -1.95 -2.46 119.26 117.78 3d1g h ALA 114 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3d1g h ALA 114 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3d1g h ALA 114 CO 0.01 0.00 -0.94 -0.25 0.00 0.00 0.00 179.25 178.07 3d1g n ASP 115 N -2.59 0.65 -4.73 0.00 8.00 -0.31 -4.94 116.55 112.62 3d1g n ASP 115 Ca 0.01 -0.35 -0.42 0.00 0.71 0.00 0.00 54.79 54.74 3d1g n ASP 115 Cb 0.22 0.75 -0.03 0.00 -0.02 0.00 0.00 41.12 42.04 3d1g n ASP 115 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 3d1g s PHE 116 N -3.13 2.92 0.06 1.24 5.36 -0.93 -4.88 117.98 118.62 3d1g s PHE 116 Ca 0.06 0.55 -0.35 0.00 -0.96 0.00 0.00 56.93 56.22 3d1g s PHE 116 Cb 0.15 -4.05 -0.14 0.00 -0.34 0.00 0.00 43.02 38.64 3d1g s PHE 116 CO 0.80 -3.85 1.59 -2.30 -1.46 0.00 0.00 175.22 170.00 3d1g n PRO 117 N 3.50 1.84 -3.99 10.12 -0.02 -1.26 -4.95 135.00 140.23 3d1g n PRO 117 Ca 0.13 0.67 -0.34 0.00 -2.02 0.00 0.00 63.50 61.94 3d1g n PRO 117 Cb 0.37 -2.41 -0.15 0.00 -0.02 0.00 0.00 33.50 31.29 3d1g n PRO 117 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 3d1g s ASN 118 N 1.64 4.31 0.21 2.55 3.04 -1.26 -5.02 114.94 120.41 3d1g s ASN 118 Ca 0.84 -1.04 -0.31 0.00 0.04 0.00 0.00 52.86 52.40 3d1g s ASN 118 Cb -0.78 -1.62 -0.10 0.00 -1.54 0.00 0.00 41.25 37.20 3d1g s ASN 118 CO 0.45 -0.15 1.54 -0.76 -3.04 0.00 0.00 177.10 175.14 3d1g s LEU 119 N 1.26 4.37 0.58 3.21 1.43 -1.26 -4.95 118.68 123.32 3d1g s LEU 119 Ca -0.02 2.69 -0.21 0.00 -1.03 0.00 0.00 54.13 55.56 3d1g s LEU 119 Cb -0.18 -3.61 -0.04 0.00 0.03 0.00 0.00 46.19 42.40 3d1g s LEU 119 CO -0.05 -0.81 1.31 0.47 0.23 0.00 0.00 176.35 177.51 3d1g n ASP 120 N 3.21 2.39 -4.76 2.29 10.43 -1.26 -4.95 116.55 123.89 3d1g n ASP 120 Ca 0.11 0.93 -0.37 0.00 2.57 0.00 0.00 54.79 58.02 3d1g n ASP 120 Cb 0.39 -1.56 0.01 0.00 1.84 0.00 0.00 41.12 41.80 3d1g n ASP 120 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 3d1g s ASP 121 N -1.06 5.80 0.16 -2.24 -1.08 -1.26 -5.04 116.67 111.96 3d1g s ASP 121 Ca 0.75 2.43 -0.07 0.00 -0.52 0.00 0.00 52.55 55.14 3d1g s ASP 121 Cb -0.41 -2.61 -0.02 0.00 -1.46 0.00 0.00 42.92 38.43 3d1g s ASP 121 CO 0.47 -1.18 0.24 -1.66 0.52 0.00 0.00 175.17 173.56 3d1g s TRP 122 N -1.50 0.52 -0.16 -5.34 1.48 -1.26 -5.16 118.94 107.52 3d1g s TRP 122 Ca 0.68 -0.88 -0.03 0.00 -1.06 0.00 0.00 56.10 54.81 3d1g s TRP 122 Cb -0.32 -0.15 -0.03 0.00 -1.16 0.00 0.00 33.47 31.82 3d1g s TRP 122 CO 0.38 -0.69 -0.04 -1.14 -4.06 0.00 0.00 176.95 171.39 3d1g s GLN 123 N -3.99 3.64 0.31 3.25 2.00 -1.26 -5.09 119.66 118.51 3d1g s GLN 123 Ca 0.20 -0.54 -0.29 0.00 -2.00 0.00 0.00 55.36 52.73 3d1g s GLN 123 Cb 0.04 -2.90 -0.10 0.00 0.80 0.00 0.00 33.01 30.85 3d1g s GLN 123 CO 0.01 0.22 1.23 0.45 -0.50 0.00 0.00 175.29 176.70 3d1g s SER 124 N 0.41 6.96 0.00 6.67 0.15 -1.26 -4.32 113.70 122.31 3d1g s SER 124 Ca -0.04 2.53 0.00 0.00 0.70 0.00 0.00 55.95 59.14 3d1g s SER 124 Cb -0.14 -2.64 0.00 0.00 -1.71 0.00 0.00 66.02 61.53 3d1g s SER 124 CO 0.03 -0.39 0.00 -0.62 1.20 0.00 0.00 173.24 173.46 3d1g n GLU 125 N 0.95 3.29 -4.47 5.44 -0.58 0.43 -4.94 120.64 120.76 3d1g n GLU 125 Ca -0.00 0.00 -0.23 0.00 -0.42 0.00 0.00 57.16 56.50 3d1g n GLU 125 Cb 0.43 -0.93 -0.16 0.00 -0.57 0.00 0.00 31.44 30.21 3d1g n GLU 125 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 3d1g s VAL 126 N -1.85 0.97 0.00 2.62 1.01 -0.55 -4.98 120.40 117.62 3d1g s VAL 126 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 61.60 3d1g s VAL 126 Cb 0.00 -0.91 -0.00 0.00 0.00 0.00 0.00 36.38 35.47 3d1g s VAL 126 CO 0.00 0.32 -0.01 -1.61 0.00 0.00 0.00 175.10 173.80 3d1g s GLU 127 N 0.73 0.12 0.13 2.72 2.02 -1.26 0.14 118.70 123.30 3d1g s GLU 127 Ca -0.14 -0.14 -0.25 0.00 0.02 0.00 0.00 54.97 54.47 3d1g s GLU 127 Cb -0.15 -0.05 0.07 0.00 0.10 0.00 0.00 34.13 34.10 3d1g s GLU 127 CO 0.03 0.01 0.80 -0.59 0.02 0.00 0.00 175.26 175.52 3d1g s PHE 128 N -0.27 -0.31 0.28 1.61 -0.71 -0.78 -5.03 117.98 112.77 3d1g s PHE 128 Ca -0.02 0.05 0.10 0.00 -1.04 0.00 0.00 56.93 56.02 3d1g s PHE 128 Cb -0.02 0.60 -0.05 0.00 -1.21 0.00 0.00 43.02 42.34 3d1g s PHE 128 CO -0.00 -0.83 -0.14 0.95 -1.34 0.00 0.00 175.22 173.85 3d1g s THR 129 N -3.49 2.15 -0.16 -4.49 -4.23 -1.26 -0.69 115.64 103.47 3d1g s THR 129 Ca 0.07 -2.28 -0.32 0.00 -1.18 0.00 0.00 61.69 57.98 3d1g s THR 129 Cb -0.02 -2.37 0.14 0.00 1.34 0.00 0.00 72.50 71.58 3d1g s THR 129 CO -0.04 -0.36 1.13 -1.48 -0.54 0.00 0.00 174.62 173.32 3d1g s LEU 130 N -3.49 -0.21 0.45 4.79 2.34 -0.48 -4.97 118.68 117.11 3d1g s LEU 130 Ca 0.29 0.07 -0.25 0.00 0.06 0.00 0.00 54.13 54.31 3d1g s LEU 130 Cb -0.01 1.55 -0.08 0.00 -0.56 0.00 0.00 46.19 47.10 3d1g s LEU 130 CO 0.13 -0.30 1.31 -2.84 -1.06 0.00 0.00 176.35 173.59 3d1g s PRO 131 N -2.19 3.73 0.28 1.48 0.02 -1.26 -0.81 135.00 136.24 3d1g s PRO 131 Ca 0.07 2.15 -0.01 0.00 0.02 0.00 0.00 61.00 63.22 3d1g s PRO 131 Cb -0.01 -2.58 0.45 0.00 0.02 0.00 0.00 34.50 32.38 3d1g s PRO 131 CO -0.05 -0.69 1.89 1.96 -0.33 0.00 0.00 177.00 179.79 3d1g h GLN 132 N 2.28 1.10 -0.27 5.54 4.20 -1.84 -1.32 115.11 124.80 3d1g h GLN 132 Ca -0.50 -0.07 0.02 0.00 0.06 0.00 0.00 58.65 58.17 3d1g h GLN 132 Cb 1.26 -0.25 -0.01 0.00 0.30 0.00 0.00 27.48 28.78 3d1g h GLN 132 CO 0.61 0.72 0.18 0.00 -0.67 0.00 0.00 178.83 179.67 3d1g h ALA 133 N 1.47 1.92 -0.22 3.87 0.00 -1.89 -0.32 119.26 124.10 3d1g h ALA 133 Ca 0.42 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 55.16 3d1g h ALA 133 Cb 0.17 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3d1g h ALA 133 CO -0.16 0.05 -0.45 1.15 0.00 0.00 0.00 179.25 179.84 3d1g h THR 134 N 0.27 1.31 -0.63 0.00 2.02 -1.61 -1.80 112.91 112.46 3d1g h THR 134 Ca 0.11 -1.67 -0.06 0.00 0.77 0.00 0.00 66.41 65.56 3d1g h THR 134 Cb 0.11 1.82 -0.03 0.00 -1.74 0.00 0.00 68.15 68.31 3d1g h THR 134 CO -0.02 0.52 0.15 -0.03 0.37 0.00 0.00 175.52 176.51 3d1g h MET 135 N 0.39 1.02 -0.49 6.66 -1.53 -1.10 -1.16 114.93 118.71 3d1g h MET 135 Ca 0.01 -0.25 -0.00 0.00 -3.44 0.00 0.00 59.70 56.02 3d1g h MET 135 Cb 1.05 -0.13 -0.02 0.00 -0.55 0.00 0.00 31.60 31.95 3d1g h MET 135 CO 0.10 0.92 0.29 -0.22 0.14 0.00 0.00 176.91 178.14 3d1g h LYS 136 N 0.93 0.67 -0.65 0.39 3.64 -1.02 -1.28 116.57 119.26 3d1g h LYS 136 Ca 0.20 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.49 3d1g h LYS 136 Cb 0.36 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 32.01 3d1g h LYS 136 CO 0.00 0.49 0.29 0.07 -2.27 0.00 0.00 179.45 178.03 3d1g h ARG 137 N 0.65 0.95 -0.60 1.90 -0.00 -1.08 0.11 114.38 116.31 3d1g h ARG 137 Ca 0.17 -0.16 -0.02 0.00 -0.00 0.00 0.00 59.98 59.98 3d1g h ARG 137 Cb 0.00 -0.16 -0.03 0.00 -0.00 0.00 0.00 29.97 29.78 3d1g h ARG 137 CO -0.03 0.78 0.30 -0.07 -0.00 0.00 0.00 179.97 180.94 3d1g h LEU 138 N 0.91 0.78 -0.05 0.08 3.38 -0.88 -1.22 115.31 118.30 3d1g h LEU 138 Ca 0.22 -0.12 -0.06 0.00 0.09 0.00 0.00 57.88 58.01 3d1g h LEU 138 Cb 0.16 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.71 3d1g h LEU 138 CO -0.02 0.68 -0.19 0.40 0.09 0.00 0.00 178.44 179.40 3d1g h ILE 139 N 0.82 1.45 -0.01 1.22 2.04 -1.02 -3.24 117.51 118.77 3d1g h ILE 139 Ca 0.21 -1.61 -0.03 0.00 1.00 0.00 0.00 64.86 64.43 3d1g h ILE 139 Cb 0.10 2.36 -0.00 0.00 -0.74 0.00 0.00 36.82 38.54 3d1g h ILE 139 CO -0.03 0.45 -0.13 -0.33 0.00 0.00 0.00 178.15 178.11 3d1g h GLU 140 N -0.32 0.01 0.00 2.37 5.08 -0.74 0.17 114.58 121.16 3d1g h GLU 140 Ca -0.01 -0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.31 3d1g h GLU 140 Cb 0.82 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.07 3d1g h GLU 140 CO 0.04 0.14 -0.20 0.00 -1.00 0.00 0.00 179.01 177.99 3d1g h ALA 141 N 1.86 1.11 0.00 3.43 0.00 -1.25 -3.37 119.26 121.05 3d1g h ALA 141 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3d1g h ALA 141 Cb 0.23 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.99 3d1g h ALA 141 CO 0.02 0.25 -0.40 0.25 0.00 0.00 0.00 179.25 179.37 3d1g n THR 142 N -3.49 0.00 -0.32 0.00 -2.24 -0.86 -4.80 114.28 102.57 3d1g n THR 142 Ca -0.01 -0.13 0.15 0.00 -2.27 0.00 0.00 64.05 61.79 3d1g n THR 142 Cb 0.36 0.60 0.33 0.00 -2.10 0.00 0.00 70.33 69.52 3d1g n THR 142 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 3d1g h GLN 143 N 0.00 0.44 0.00 -0.78 4.15 -0.84 -1.56 115.11 116.52 3d1g h GLN 143 Ca 0.00 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.39 3d1g h GLN 143 Cb 0.00 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 27.59 3d1g h GLN 143 CO 0.00 0.29 0.00 0.27 -1.93 0.00 0.00 178.83 177.46 3d1g h PHE 144 N 0.46 0.00 -0.09 3.99 -0.00 -1.84 -2.48 116.94 116.98 3d1g h PHE 144 Ca 0.59 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.56 3d1g h PHE 144 Cb 1.11 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.06 3d1g h PHE 144 CO -0.09 0.00 0.00 0.43 -0.00 0.00 0.00 178.31 178.65 3d1g n SER 145 N -2.88 1.71 -4.78 -0.68 7.64 -0.59 -4.92 113.62 109.13 3d1g n SER 145 Ca -0.02 -1.62 -0.35 0.00 1.01 0.00 0.00 58.87 57.89 3d1g n SER 145 Cb 0.11 -0.05 0.01 0.00 -1.01 0.00 0.00 64.21 63.27 3d1g n SER 145 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 3d1g s MET 146 N -1.90 3.31 0.88 1.43 -1.94 -0.94 -2.51 119.30 117.63 3d1g s MET 146 Ca 0.35 1.56 -0.11 0.00 -1.71 0.00 0.00 55.69 55.77 3d1g s MET 146 Cb 0.20 -2.00 0.12 0.00 2.01 0.00 0.00 34.83 35.15 3d1g s MET 146 CO 0.31 -0.87 1.09 0.00 -0.01 0.00 0.00 175.02 175.53 3d1g s ALA 147 N -1.88 1.66 -0.31 3.03 0.00 -0.43 -4.75 121.76 119.08 3d1g s ALA 147 Ca 0.71 -0.06 0.03 0.00 0.00 0.00 0.00 51.96 52.64 3d1g s ALA 147 Cb -0.23 -3.19 0.09 0.00 0.00 0.00 0.00 23.12 19.80 3d1g s ALA 147 CO 0.29 -2.25 0.03 -1.01 0.00 0.00 0.00 175.76 172.82 3d1g s HIS 148 N -2.96 3.14 -1.51 0.00 3.76 -1.26 -4.51 115.29 111.96 3d1g s HIS 148 Ca 0.63 -2.54 -0.05 0.00 -0.15 0.00 0.00 55.06 52.95 3d1g s HIS 148 Cb -0.18 -2.42 0.02 0.00 1.11 0.00 0.00 32.58 31.11 3d1g s HIS 148 CO 0.57 -0.91 0.51 1.04 -0.85 0.00 0.00 174.74 175.10 3d1g n GLN 149 N 4.44 -4.26 -2.38 1.40 3.00 -1.26 -4.97 117.38 113.35 3d1g n GLN 149 Ca -0.01 0.82 -0.34 0.00 -0.01 0.00 0.00 57.00 57.46 3d1g n GLN 149 Cb 0.42 -5.63 -0.02 0.00 0.00 0.00 0.00 30.24 25.01 3d1g n GLN 149 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 3d1g s ASP 150 N -2.63 6.06 0.46 1.08 -1.08 -1.26 -4.91 116.67 114.38 3d1g s ASP 150 Ca 0.29 2.00 0.30 0.00 -0.52 0.00 0.00 52.55 54.62 3d1g s ASP 150 Cb -0.13 -2.56 1.22 0.00 -1.46 0.00 0.00 42.92 39.99 3d1g s ASP 150 CO 0.35 -0.98 1.90 -0.37 0.52 0.00 0.00 175.17 176.59 3d1g h VAL 151 N 1.30 0.00 -0.89 1.11 -1.51 -2.03 -3.21 116.25 111.01 3d1g h VAL 151 Ca -0.49 -0.45 -0.73 0.00 -1.23 0.00 0.00 66.70 63.80 3d1g h VAL 151 Cb 1.23 1.37 -0.11 0.00 -2.13 0.00 0.00 31.29 31.66 3d1g h VAL 151 CO 0.58 0.00 2.40 0.54 -1.23 0.00 0.00 177.57 179.86 3d1g n ARG 152 N -2.84 3.29 -0.39 5.19 1.74 -1.26 -4.81 116.66 117.57 3d1g n ARG 152 Ca 0.01 -3.19 0.35 0.00 -0.77 0.00 0.00 57.85 54.25 3d1g n ARG 152 Cb 0.29 -3.11 0.60 0.00 -1.02 0.00 0.00 32.46 29.22 3d1g n ARG 152 CO 0.00 0.00 0.00 2.48 -1.52 0.00 0.00 177.63 178.59 3d1g n TYR 153 N 5.14 0.75 0.29 -1.55 4.11 -1.22 0.41 117.16 125.10 3d1g n TYR 153 Ca 0.45 0.76 0.15 0.00 -0.00 0.00 0.00 57.90 59.26 3d1g n TYR 153 Cb 0.38 -1.18 0.88 0.00 -0.00 0.00 0.00 39.34 39.42 3d1g n TYR 153 CO 0.00 0.00 0.00 0.10 -0.00 0.00 0.00 176.86 176.96 3d1g h TYR 154 N 0.00 0.00 0.00 -3.48 -0.00 -1.90 -1.73 116.97 109.86 3d1g h TYR 154 Ca 0.80 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.53 3d1g h TYR 154 Cb 2.45 0.00 0.00 0.00 0.00 0.00 0.00 36.73 39.18 3d1g h TYR 154 CO -0.01 0.05 -0.10 -0.07 -0.00 0.00 0.00 178.16 178.03 3d1g h LEU 155 N 0.00 0.00 0.00 0.10 3.38 -0.36 -3.20 115.31 115.23 3d1g h LEU 155 Ca -0.00 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3d1g h LEU 155 Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 3d1g h LEU 155 CO 0.01 0.02 0.00 0.59 0.09 0.00 0.00 178.44 179.14 3d1g n ASN 156 N -2.35 0.00 -0.60 -0.43 5.03 -0.65 -1.31 115.26 114.94 3d1g n ASN 156 Ca 0.05 0.14 0.00 0.00 0.87 0.00 0.00 54.58 55.64 3d1g n ASN 156 Cb 0.45 -0.35 0.00 0.00 -1.02 0.00 0.00 39.78 38.85 3d1g n ASN 156 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3d1g n GLY 157 N 0.62 5.03 3.05 7.41 0.00 -1.21 -3.34 105.19 116.75 3d1g n GLY 157 Ca 0.09 -2.08 -0.25 0.00 0.00 0.00 0.00 46.02 43.78 3d1g n GLY 157 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3d1g s MET 158 N 0.59 1.79 0.07 1.61 1.75 0.07 -4.72 119.30 120.46 3d1g s MET 158 Ca 0.00 -0.47 -0.30 0.00 -1.25 0.00 0.00 55.69 53.67 3d1g s MET 158 Cb 0.00 -1.47 -0.05 0.00 2.84 0.00 0.00 34.83 36.15 3d1g s MET 158 CO 0.00 0.06 1.01 -1.17 -0.65 0.00 0.00 175.02 174.27 3d1g s LEU 159 N 0.56 4.44 -0.21 4.11 2.96 -0.27 -0.64 118.68 129.63 3d1g s LEU 159 Ca -0.14 1.80 0.00 0.00 -0.22 0.00 0.00 54.13 55.58 3d1g s LEU 159 Cb -0.15 -3.58 0.02 0.00 0.50 0.00 0.00 46.19 42.98 3d1g s LEU 159 CO 0.04 -0.19 -0.14 -0.36 -1.32 0.00 0.00 176.35 174.38 3d1g s PHE 160 N 0.43 2.92 -0.03 5.38 0.40 0.10 -1.57 117.98 125.61 3d1g s PHE 160 Ca 0.50 -1.62 0.05 0.00 -0.60 0.00 0.00 56.93 55.26 3d1g s PHE 160 Cb -0.24 -1.97 -0.01 0.00 0.51 0.00 0.00 43.02 41.31 3d1g s PHE 160 CO 0.30 -0.77 -0.17 -2.00 0.70 0.00 0.00 175.22 173.28 3d1g s GLU 161 N 1.30 1.55 -0.11 0.44 2.12 0.10 -1.01 118.70 123.10 3d1g s GLU 161 Ca 0.02 -0.61 -0.02 0.00 0.36 0.00 0.00 54.97 54.73 3d1g s GLU 161 Cb -0.15 -1.43 -0.03 0.00 0.26 0.00 0.00 34.13 32.78 3d1g s GLU 161 CO -0.09 0.31 -0.03 0.95 -0.54 0.00 0.00 175.26 175.86 3d1g s THR 162 N -0.21 4.00 -0.28 -1.70 -4.23 0.53 0.30 115.64 114.05 3d1g s THR 162 Ca 0.02 -0.35 -0.11 0.00 -1.18 0.00 0.00 61.69 60.07 3d1g s THR 162 Cb -0.09 -2.69 0.11 0.00 1.34 0.00 0.00 72.50 71.17 3d1g s THR 162 CO 0.01 0.56 0.63 -0.70 -0.54 0.00 0.00 174.62 174.57 3d1g s GLU 163 N -0.41 0.58 7.87 3.99 2.12 -0.62 -2.02 118.70 130.22 3d1g s GLU 163 Ca 0.07 1.32 0.00 0.00 0.36 0.00 0.00 54.97 56.72 3d1g s GLU 163 Cb -0.12 0.56 0.00 0.00 0.26 0.00 0.00 34.13 34.83 3d1g s GLU 163 CO 0.02 -0.19 0.00 0.41 -0.54 0.00 0.00 175.26 174.96 3d1g n GLY 164 N 5.05 3.58 0.74 -1.50 0.00 -1.25 -1.34 105.19 110.47 3d1g n GLY 164 Ca -0.15 -0.07 0.08 0.00 0.00 0.00 0.00 46.02 45.89 3d1g n GLY 164 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3d1g n GLU 165 N 13.47 2.55 -4.45 1.61 1.02 -1.26 -0.56 120.64 133.02 3d1g n GLU 165 Ca 0.00 -2.81 -0.30 0.00 -0.02 0.00 0.00 57.16 54.03 3d1g n GLU 165 Cb 0.00 -1.78 -0.12 0.00 -0.02 0.00 0.00 31.44 29.52 3d1g n GLU 165 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3d1g s GLU 166 N -2.86 1.82 -0.10 3.49 2.02 -0.45 -1.01 118.70 121.61 3d1g s GLU 166 Ca 0.40 -1.14 0.01 0.00 0.02 0.00 0.00 54.97 54.26 3d1g s GLU 166 Cb 0.33 -2.10 -0.02 0.00 0.10 0.00 0.00 34.13 32.44 3d1g s GLU 166 CO 0.07 0.50 -0.12 -1.17 0.02 0.00 0.00 175.26 174.56 3d1g s LEU 167 N -1.88 2.82 0.04 1.80 2.96 -0.60 -1.58 118.68 122.24 3d1g s LEU 167 Ca 0.16 -0.24 0.04 0.00 -0.22 0.00 0.00 54.13 53.87 3d1g s LEU 167 Cb -0.10 -1.62 -0.02 0.00 0.50 0.00 0.00 46.19 44.95 3d1g s LEU 167 CO 0.08 0.24 -0.12 -0.60 -1.32 0.00 0.00 176.35 174.63 3d1g s ARG 168 N -0.10 0.76 0.06 1.98 3.52 0.15 -1.40 118.95 123.92 3d1g s ARG 168 Ca -0.01 -0.72 0.09 0.00 -0.13 0.00 0.00 55.73 54.96 3d1g s ARG 168 Cb -0.14 -0.71 -0.03 0.00 -1.56 0.00 0.00 34.95 32.51 3d1g s ARG 168 CO 0.03 0.17 -0.24 0.95 -0.81 0.00 0.00 175.30 175.40 3d1g s THR 169 N -0.95 2.34 -0.01 4.11 -4.23 -0.23 0.01 115.64 116.68 3d1g s THR 169 Ca -0.02 -1.39 0.01 0.00 -1.18 0.00 0.00 61.69 59.11 3d1g s THR 169 Cb -0.08 -1.96 0.00 0.00 1.34 0.00 0.00 72.50 71.81 3d1g s THR 169 CO 0.01 0.31 -0.02 -0.69 -0.54 0.00 0.00 174.62 173.69 3d1g s VAL 170 N -0.88 0.20 -0.03 2.29 1.01 -0.61 -1.52 120.40 120.85 3d1g s VAL 170 Ca 0.13 -0.09 -0.03 0.00 0.00 0.00 0.00 61.98 61.99 3d1g s VAL 170 Cb -0.10 -0.19 0.01 0.00 0.00 0.00 0.00 36.38 36.10 3d1g s VAL 170 CO 0.04 0.07 0.09 0.00 0.00 0.00 0.00 175.10 175.29 3d1g s ALA 171 N 0.07 -0.21 -0.07 5.51 0.00 -0.44 -1.11 121.76 125.51 3d1g s ALA 171 Ca -0.00 0.27 -0.30 0.00 0.00 0.00 0.00 51.96 51.92 3d1g s ALA 171 Cb -0.03 -0.16 0.07 0.00 0.00 0.00 0.00 23.12 23.01 3d1g s ALA 171 CO -0.00 -0.05 0.68 -0.08 0.00 0.00 0.00 175.76 176.31 3d1g s THR 172 N 0.11 0.00 -0.17 0.00 -1.32 -1.05 -0.83 115.64 112.39 3d1g s THR 172 Ca -0.01 -0.00 0.08 0.00 -1.21 0.00 0.00 61.69 60.55 3d1g s THR 172 Cb -0.01 -1.00 0.15 0.00 -1.51 0.00 0.00 72.50 70.13 3d1g s THR 172 CO -0.00 -0.00 1.10 -0.90 -2.21 0.00 0.00 174.62 172.61 3d1g n ASP 173 N 1.06 2.34 0.00 8.08 5.68 -1.04 -3.66 116.55 129.01 3d1g n ASP 173 Ca -0.19 -2.37 0.00 0.00 -0.50 0.00 0.00 54.79 51.74 3d1g n ASP 173 Cb 0.57 -0.18 0.00 0.00 -1.14 0.00 0.00 41.12 40.36 3d1g n ASP 173 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3d1g n GLY 174 N -0.63 1.96 0.05 6.12 0.00 -1.26 -4.78 105.19 106.65 3d1g n GLY 174 Ca 0.07 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.04 3d1g n GLY 174 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3d1g n HIS 175 N -2.00 0.00 -3.82 1.61 8.25 -1.26 -5.00 115.22 112.99 3d1g n HIS 175 Ca 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.34 3d1g n HIS 175 Cb 0.00 -0.45 -0.09 0.00 1.12 0.00 0.00 29.99 30.58 3d1g n HIS 175 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 3d1g s ARG 176 N -2.22 0.63 0.07 -0.41 1.04 -1.26 -1.91 118.95 114.89 3d1g s ARG 176 Ca -0.08 -0.41 0.05 0.00 -1.04 0.00 0.00 55.73 54.25 3d1g s ARG 176 Cb 0.03 0.27 -0.03 0.00 -2.04 0.00 0.00 34.95 33.18 3d1g s ARG 176 CO 0.34 -0.17 -0.14 -1.17 -0.04 0.00 0.00 175.30 174.12 3d1g s LEU 177 N -1.62 2.29 -0.03 -1.89 0.20 0.38 -2.74 118.68 115.27 3d1g s LEU 177 Ca -0.11 -0.64 0.02 0.00 0.69 0.00 0.00 54.13 54.09 3d1g s LEU 177 Cb -0.04 -0.49 0.01 0.00 -0.43 0.00 0.00 46.19 45.24 3d1g s LEU 177 CO 0.00 -0.10 -0.06 0.00 -0.29 0.00 0.00 176.35 175.90 3d1g s ALA 178 N -1.39 0.68 -0.01 5.97 0.00 -0.01 -1.20 121.76 125.80 3d1g s ALA 178 Ca -0.01 -0.20 0.00 0.00 0.00 0.00 0.00 51.96 51.75 3d1g s ALA 178 Cb -0.09 -0.30 0.01 0.00 0.00 0.00 0.00 23.12 22.74 3d1g s ALA 178 CO 0.02 0.08 0.01 0.54 0.00 0.00 0.00 175.76 176.41 3d1g s VAL 179 N 0.38 0.03 -0.01 0.00 0.11 -0.23 -1.33 120.40 119.34 3d1g s VAL 179 Ca -0.05 0.08 0.00 0.00 -2.93 0.00 0.00 61.98 59.08 3d1g s VAL 179 Cb -0.09 -0.09 0.01 0.00 -1.53 0.00 0.00 36.38 34.67 3d1g s VAL 179 CO 0.00 0.06 -0.01 0.00 -3.33 0.00 0.00 175.10 171.82 3d1g s SER 181 N 0.37 1.80 -0.00 0.00 0.15 -0.24 -1.07 113.70 114.70 3d1g s SER 181 Ca -0.03 -0.28 0.01 0.00 0.70 0.00 0.00 55.95 56.35 3d1g s SER 181 Cb -0.06 -0.26 -0.00 0.00 -1.71 0.00 0.00 66.02 64.00 3d1g s SER 181 CO -0.01 0.17 -0.02 -0.04 1.20 0.00 0.00 173.24 174.54 3d1g s MET 182 N -0.27 0.20 0.24 5.44 -1.94 -0.49 -4.81 119.30 117.66 3d1g s MET 182 Ca 0.04 -0.08 -0.30 0.00 -1.71 0.00 0.00 55.69 53.65 3d1g s MET 182 Cb -0.07 -0.20 -0.09 0.00 2.01 0.00 0.00 34.83 36.48 3d1g s MET 182 CO -0.00 0.04 1.02 -1.25 -0.01 0.00 0.00 175.02 174.81 3d1g s PRO 183 N 0.01 4.74 -0.08 2.03 0.04 -1.26 -1.55 135.00 138.92 3d1g s PRO 183 Ca 0.00 1.62 0.12 0.00 0.04 0.00 0.00 61.00 62.78 3d1g s PRO 183 Cb -0.02 -3.26 0.18 0.00 0.04 0.00 0.00 34.50 31.45 3d1g s PRO 183 CO -0.00 0.34 1.07 0.44 0.04 0.00 0.00 177.00 178.88 3d1g n ILE 184 N 1.60 1.29 -3.90 0.56 -0.00 -0.18 -4.95 119.36 113.78 3d1g n ILE 184 Ca -0.01 -1.53 -0.30 0.00 -0.00 0.00 0.00 62.75 60.92 3d1g n ILE 184 Cb 0.46 0.07 0.03 0.00 -0.00 0.00 0.00 39.64 40.20 3d1g n ILE 184 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 3d1g n GLY 185 N -0.95 -0.50 3.27 3.28 0.00 -1.26 -4.91 105.19 104.13 3d1g n GLY 185 Ca 0.10 0.20 -0.13 0.00 0.00 0.00 0.00 46.02 46.19 3d1g n GLY 185 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3d1g s GLN 186 N -6.61 0.44 -0.18 1.61 -0.21 -1.26 -5.13 119.66 108.32 3d1g s GLN 186 Ca 0.67 0.55 -0.29 0.00 0.02 0.00 0.00 55.36 56.31 3d1g s GLN 186 Cb -0.33 0.20 -0.01 0.00 1.00 0.00 0.00 33.01 33.87 3d1g s GLN 186 CO 0.83 -0.06 1.17 -1.12 -2.12 0.00 0.00 175.29 173.98 3d1g s SER 187 N 0.30 7.02 0.29 5.90 0.01 -1.26 -4.10 113.70 121.86 3d1g s SER 187 Ca -0.01 1.58 0.11 0.00 1.31 0.00 0.00 55.95 58.94 3d1g s SER 187 Cb -0.03 -2.54 -0.05 0.00 0.21 0.00 0.00 66.02 63.60 3d1g s SER 187 CO -0.01 -0.70 -0.17 -0.76 0.41 0.00 0.00 173.24 172.01 3d1g s LEU 188 N 3.24 2.61 0.57 2.44 2.01 0.28 -5.01 118.68 124.81 3d1g s LEU 188 Ca 0.51 -1.07 -0.10 0.00 0.01 0.00 0.00 54.13 53.48 3d1g s LEU 188 Cb -0.19 -1.04 -0.04 0.00 0.01 0.00 0.00 46.19 44.93 3d1g s LEU 188 CO 0.12 -0.03 0.95 -2.84 1.01 0.00 0.00 176.35 175.56 3d1g s PRO 189 N -3.54 3.61 -0.41 1.29 0.02 -1.26 -3.90 135.00 130.80 3d1g s PRO 189 Ca 0.30 0.59 -0.28 0.00 0.02 0.00 0.00 61.00 61.63 3d1g s PRO 189 Cb -0.03 -2.18 0.02 0.00 0.02 0.00 0.00 34.50 32.33 3d1g s PRO 189 CO 0.15 -0.43 1.05 -1.12 -0.33 0.00 0.00 177.00 176.32 3d1g s SER 190 N -4.06 6.71 0.01 2.53 0.01 -1.26 -4.18 113.70 113.46 3d1g s SER 190 Ca 0.53 0.61 -0.18 0.00 1.31 0.00 0.00 55.95 58.22 3d1g s SER 190 Cb -0.11 -2.52 0.03 0.00 0.21 0.00 0.00 66.02 63.64 3d1g s SER 190 CO 0.49 -1.04 0.39 -2.28 0.41 0.00 0.00 173.24 171.21 3d1g s HIS 191 N 3.94 -0.26 -0.12 2.43 5.04 -0.86 -5.00 115.29 120.47 3d1g s HIS 191 Ca 0.44 0.30 -0.11 0.00 -1.54 0.00 0.00 55.06 54.16 3d1g s HIS 191 Cb -0.10 0.18 0.03 0.00 0.04 0.00 0.00 32.58 32.74 3d1g s HIS 191 CO 0.24 -0.51 0.31 -1.54 -2.34 0.00 0.00 174.74 170.90 3d1g s SER 192 N -1.70 -0.33 0.11 9.88 1.04 -1.26 -0.35 113.70 121.09 3d1g s SER 192 Ca -0.09 0.63 0.00 0.00 0.48 0.00 0.00 55.95 56.98 3d1g s SER 192 Cb -0.02 0.63 -0.04 0.00 0.10 0.00 0.00 66.02 66.69 3d1g s SER 192 CO 0.01 -0.11 -0.01 0.68 0.98 0.00 0.00 173.24 174.79 3d1g s VAL 193 N 0.21 0.41 -0.22 5.02 -7.23 -0.18 -4.97 120.40 113.45 3d1g s VAL 193 Ca -0.00 -1.90 -0.04 0.00 -1.81 0.00 0.00 61.98 58.22 3d1g s VAL 193 Cb -0.02 -1.81 -0.01 0.00 0.56 0.00 0.00 36.38 35.10 3d1g s VAL 193 CO -0.00 -0.73 -0.04 -0.63 -0.31 0.00 0.00 175.10 173.39 3d1g s ILE 194 N -3.82 3.45 -0.17 -0.62 1.01 -1.26 0.00 121.20 119.79 3d1g s ILE 194 Ca 0.16 -0.47 -0.13 0.00 0.00 0.00 0.00 60.65 60.21 3d1g s ILE 194 Cb 0.07 -2.57 -0.05 0.00 0.01 0.00 0.00 42.46 39.92 3d1g s ILE 194 CO -0.03 0.42 0.28 -0.69 0.00 0.00 0.00 174.94 174.92 3d1g s VAL 195 N 1.42 5.31 0.67 2.92 1.01 0.18 -1.10 120.40 130.82 3d1g s VAL 195 Ca 0.05 0.51 -0.17 0.00 0.00 0.00 0.00 61.98 62.37 3d1g s VAL 195 Cb -0.14 -3.62 -0.01 0.00 0.00 0.00 0.00 36.38 32.61 3d1g s VAL 195 CO -0.02 0.37 1.04 -2.65 0.00 0.00 0.00 175.10 173.84 3d1g n PRO 196 N 3.72 0.73 -0.18 2.72 -0.02 -1.26 -0.75 135.00 139.96 3d1g n PRO 196 Ca -0.12 0.30 -0.02 0.00 -2.02 0.00 0.00 63.50 61.64 3d1g n PRO 196 Cb 0.52 -2.28 0.05 0.00 -0.02 0.00 0.00 33.50 31.77 3d1g n PRO 196 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 3d1g h ARG 197 N 0.10 0.01 -0.51 -0.52 2.43 -1.89 0.11 114.38 114.10 3d1g h ARG 197 Ca -0.48 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 58.68 3d1g h ARG 197 Cb 1.34 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.87 3d1g h ARG 197 CO 0.49 0.00 0.31 -0.22 -1.51 0.00 0.00 179.97 179.05 3d1g h LYS 198 N 0.01 0.69 -0.51 0.20 3.64 -1.90 -1.86 116.57 116.83 3d1g h LYS 198 Ca 0.27 -0.05 -0.12 0.00 -1.27 0.00 0.00 60.65 59.48 3d1g h LYS 198 Cb 0.41 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 32.06 3d1g h LYS 198 CO -0.56 0.48 -0.14 0.78 -2.27 0.00 0.00 179.45 177.74 3d1g h GLY 199 N 0.74 1.08 0.95 5.01 0.00 -1.18 -1.64 103.07 108.02 3d1g h GLY 199 Ca 0.19 -0.90 -0.01 0.00 0.00 0.00 0.00 47.33 46.60 3d1g h GLY 199 CO -0.04 0.82 0.18 -2.08 0.00 0.00 0.00 176.54 175.42 3d1g h VAL 200 N 0.86 1.15 -0.36 4.60 2.07 -0.50 0.40 116.25 124.48 3d1g h VAL 200 Ca 0.13 -0.42 0.03 0.00 0.82 0.00 0.00 66.70 67.26 3d1g h VAL 200 Cb 0.71 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 31.24 3d1g h VAL 200 CO 0.05 0.16 0.15 0.40 0.02 0.00 0.00 177.57 178.35 3d1g h ILE 201 N 0.43 0.94 -0.61 4.57 1.08 -1.22 -1.50 117.51 121.19 3d1g h ILE 201 Ca 0.12 -0.11 -0.06 0.00 -0.39 0.00 0.00 64.86 64.43 3d1g h ILE 201 Cb 0.09 0.59 -0.03 0.00 -3.07 0.00 0.00 36.82 34.41 3d1g h ILE 201 CO -0.02 0.06 0.15 -0.08 -0.69 0.00 0.00 178.15 177.57 3d1g h GLU 202 N 0.32 0.94 -0.22 2.37 4.57 -1.03 -1.40 114.58 120.13 3d1g h GLU 202 Ca 0.16 -0.20 -0.01 0.00 -1.18 0.00 0.00 59.36 58.13 3d1g h GLU 202 Cb 0.10 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 28.55 3d1g h GLU 202 CO -0.14 0.84 0.11 1.25 -1.18 0.00 0.00 179.01 179.89 3d1g h LEU 203 N 0.90 0.28 -1.04 1.64 6.46 -0.46 -2.45 115.31 120.65 3d1g h LEU 203 Ca 0.20 -0.11 -0.01 0.00 -0.12 0.00 0.00 57.88 57.83 3d1g h LEU 203 Cb 0.32 -0.07 -0.04 0.00 -0.73 0.00 0.00 40.66 40.13 3d1g h LEU 203 CO -0.00 0.32 0.51 -0.03 -0.62 0.00 0.00 178.44 178.62 3d1g h MET 204 N 0.23 1.18 0.00 1.25 4.05 -1.03 -2.51 114.93 118.09 3d1g h MET 204 Ca 0.08 -0.11 -0.03 0.00 -0.28 0.00 0.00 59.70 59.36 3d1g h MET 204 Cb 0.11 -0.25 -0.00 0.00 -0.80 0.00 0.00 31.60 30.66 3d1g h MET 204 CO -0.01 0.83 -0.15 -0.09 0.23 0.00 0.00 176.91 177.72 3d1g h ARG 205 N 1.19 0.00 0.00 0.39 2.43 -0.89 -2.61 114.38 114.90 3d1g h ARG 205 Ca 0.31 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.48 3d1g h ARG 205 Cb -0.04 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.51 3d1g h ARG 205 CO -0.06 0.15 -0.22 0.00 -1.51 0.00 0.00 179.97 178.33 3d1g n MET 206 N -3.61 0.18 -2.89 0.20 0.00 -0.95 -4.76 117.12 105.30 3d1g n MET 206 Ca -0.01 0.11 -0.42 0.00 0.00 0.00 0.00 57.70 57.37 3d1g n MET 206 Cb 0.28 -1.67 -0.04 0.00 0.00 0.00 0.00 33.22 31.78 3d1g n MET 206 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 3d1g s LEU 207 N -3.95 4.06 -0.12 3.17 1.43 -0.98 -4.91 118.68 117.38 3d1g s LEU 207 Ca 0.10 0.56 -0.01 0.00 -1.03 0.00 0.00 54.13 53.75 3d1g s LEU 207 Cb 0.15 -3.15 -0.24 0.00 0.03 0.00 0.00 46.19 42.98 3d1g s LEU 207 CO 0.63 -0.74 0.34 0.47 0.23 0.00 0.00 176.35 177.27 3d1g n ASP 208 N 6.49 1.78 0.00 2.29 8.00 -1.26 -5.02 116.55 128.84 3d1g n ASP 208 Ca 0.05 0.20 0.00 0.00 0.71 0.00 0.00 54.79 55.75 3d1g n ASP 208 Cb 0.48 -0.58 0.00 0.00 -0.02 0.00 0.00 41.12 41.00 3d1g n ASP 208 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3d1g n GLY 209 N 1.93 0.99 3.32 0.44 0.00 -1.26 -5.12 105.19 105.49 3d1g n GLY 209 Ca -0.31 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.36 3d1g n GLY 209 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d1g n GLY 210 N 0.00 -2.58 0.00 -0.02 0.00 -1.26 -4.73 105.19 96.60 3d1g n GLY 210 Ca 0.00 -0.58 0.01 0.00 0.00 0.00 0.00 46.02 45.45 3d1g n GLY 210 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3d1g n ASP 211 N 0.54 0.00 -4.63 1.61 8.00 -1.26 -4.69 116.55 116.12 3d1g n ASP 211 Ca 0.06 -0.16 -0.43 0.00 0.71 0.00 0.00 54.79 54.97 3d1g n ASP 211 Cb 0.52 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.59 3d1g n ASP 211 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 3d1g s ASN 212 N -1.95 5.98 0.62 -2.24 3.84 -1.26 -4.92 114.94 115.00 3d1g s ASN 212 Ca 0.03 2.25 -0.18 0.00 0.21 0.00 0.00 52.86 55.17 3d1g s ASN 212 Cb 0.01 -2.52 -0.02 0.00 -0.55 0.00 0.00 41.25 38.17 3d1g s ASN 212 CO 0.02 -1.49 1.21 -2.16 -2.79 0.00 0.00 177.10 171.89 3d1g s PRO 213 N 5.36 2.83 -0.21 0.43 0.04 -1.26 -4.22 135.00 137.96 3d1g s PRO 213 Ca 0.93 1.81 -0.07 0.00 0.04 0.00 0.00 61.00 63.71 3d1g s PRO 213 Cb -0.37 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.22 3d1g s PRO 213 CO 0.38 -1.32 0.06 -1.17 0.04 0.00 0.00 177.00 174.99 3d1g s LEU 214 N -4.28 3.63 -0.24 -3.56 2.96 0.01 -4.49 118.68 112.70 3d1g s LEU 214 Ca 0.77 -0.05 -0.08 0.00 -0.22 0.00 0.00 54.13 54.56 3d1g s LEU 214 Cb -0.30 -1.94 -0.03 0.00 0.50 0.00 0.00 46.19 44.42 3d1g s LEU 214 CO 0.35 0.09 0.08 -0.13 -1.32 0.00 0.00 176.35 175.42 3d1g s ARG 215 N 0.86 3.71 -0.08 1.98 3.00 -0.43 -1.38 118.95 126.62 3d1g s ARG 215 Ca 0.03 -0.45 0.02 0.00 0.00 0.00 0.00 55.73 55.33 3d1g s ARG 215 Cb -0.14 -3.34 -0.02 0.00 0.00 0.00 0.00 34.95 31.45 3d1g s ARG 215 CO 0.02 -0.13 -0.13 0.08 0.00 0.00 0.00 175.30 175.15 3d1g s VAL 216 N 1.48 3.17 -0.06 3.52 1.01 0.13 -0.38 120.40 129.27 3d1g s VAL 216 Ca 0.06 -0.66 0.02 0.00 0.00 0.00 0.00 61.98 61.39 3d1g s VAL 216 Cb -0.15 -2.28 0.02 0.00 0.00 0.00 0.00 36.38 33.97 3d1g s VAL 216 CO 0.04 0.57 -0.09 -1.10 0.00 0.00 0.00 175.10 174.52 3d1g s GLN 217 N -0.41 1.39 -0.11 2.72 -0.21 -0.10 -1.87 119.66 121.07 3d1g s GLN 217 Ca 0.05 -0.30 0.03 0.00 0.02 0.00 0.00 55.36 55.17 3d1g s GLN 217 Cb -0.12 -1.22 0.00 0.00 1.00 0.00 0.00 33.01 32.67 3d1g s GLN 217 CO 0.02 -0.03 -0.22 0.42 -2.12 0.00 0.00 175.29 173.36 3d1g s ILE 218 N 0.83 1.97 0.16 1.08 1.01 0.12 -0.58 121.20 125.79 3d1g s ILE 218 Ca -0.12 -0.95 0.01 0.00 0.00 0.00 0.00 60.65 59.59 3d1g s ILE 218 Cb -0.15 -1.73 0.01 0.00 0.01 0.00 0.00 42.46 40.61 3d1g s ILE 218 CO 0.02 0.54 0.11 0.61 0.00 0.00 0.00 174.94 176.21 3d1g n GLY 219 N 3.75 3.05 0.28 6.18 0.00 0.17 -0.43 105.19 118.19 3d1g n GLY 219 Ca -0.20 -2.21 0.02 0.00 0.00 0.00 0.00 46.02 43.63 3d1g n GLY 219 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3d1g h SER 220 N 0.20 0.44 0.00 1.61 0.02 -1.97 -3.30 113.55 110.55 3d1g h SER 220 Ca -0.10 -0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 60.77 3d1g h SER 220 Cb 0.36 -0.11 -0.03 0.00 0.14 0.00 0.00 62.40 62.76 3d1g h SER 220 CO 0.16 0.46 -0.49 0.59 -1.14 0.00 0.00 176.83 176.41 3d1g n ASN 221 N -4.34 0.34 -3.75 3.07 4.13 -1.26 -4.97 115.26 108.49 3d1g n ASN 221 Ca 0.02 -2.13 -0.11 0.00 1.68 0.00 0.00 54.58 54.03 3d1g n ASN 221 Cb 0.19 -0.24 -0.07 0.00 -1.54 0.00 0.00 39.78 38.12 3d1g n ASN 221 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 3d1g s ASN 222 N -1.30 -0.13 0.00 6.41 -0.87 -1.24 -1.61 114.94 116.20 3d1g s ASN 222 Ca 0.06 -0.21 0.02 0.00 -1.57 0.00 0.00 52.86 51.17 3d1g s ASN 222 Cb 0.06 0.37 -0.01 0.00 -0.02 0.00 0.00 41.25 41.65 3d1g s ASN 222 CO -0.01 -0.63 -0.07 -0.51 -2.57 0.00 0.00 177.10 173.30 3d1g s ILE 223 N -2.67 0.55 -0.02 0.60 2.07 -0.37 0.44 121.20 121.80 3d1g s ILE 223 Ca -0.04 -0.37 0.02 0.00 -1.41 0.00 0.00 60.65 58.85 3d1g s ILE 223 Cb -0.00 -0.48 0.00 0.00 0.13 0.00 0.00 42.46 42.11 3d1g s ILE 223 CO -0.04 0.10 -0.09 -0.60 -1.91 0.00 0.00 174.94 172.40 3d1g s ARG 224 N -0.31 0.89 -0.08 3.50 3.52 0.26 -1.09 118.95 125.64 3d1g s ARG 224 Ca 0.02 -0.29 0.03 0.00 -0.13 0.00 0.00 55.73 55.35 3d1g s ARG 224 Cb -0.03 -0.84 0.01 0.00 -1.56 0.00 0.00 34.95 32.53 3d1g s ARG 224 CO -0.00 0.11 -0.17 0.00 -0.81 0.00 0.00 175.30 174.44 3d1g s ALA 225 N 0.15 1.63 -0.13 6.12 0.00 0.23 -0.93 121.76 128.84 3d1g s ALA 225 Ca -0.02 -0.64 0.03 0.00 0.00 0.00 0.00 51.96 51.32 3d1g s ALA 225 Cb -0.08 -0.68 0.01 0.00 0.00 0.00 0.00 23.12 22.37 3d1g s ALA 225 CO 0.00 0.16 -0.22 -1.58 0.00 0.00 0.00 175.76 174.12 3d1g s HIS 226 N 0.58 2.65 -0.06 0.00 2.46 0.49 -0.44 115.29 120.98 3d1g s HIS 226 Ca -0.15 -1.23 -0.01 0.00 0.47 0.00 0.00 55.06 54.14 3d1g s HIS 226 Cb -0.17 -1.79 0.03 0.00 -0.13 0.00 0.00 32.58 30.52 3d1g s HIS 226 CO 0.05 -0.54 -0.00 0.08 -2.47 0.00 0.00 174.74 171.86 3d1g s VAL 227 N 0.68 0.33 0.00 0.89 1.01 -0.08 -1.31 120.40 121.92 3d1g s VAL 227 Ca -0.10 0.10 0.00 0.00 0.00 0.00 0.00 61.98 61.98 3d1g s VAL 227 Cb -0.16 -0.47 0.00 0.00 0.00 0.00 0.00 36.38 35.75 3d1g s VAL 227 CO 0.01 0.23 0.00 0.61 0.00 0.00 0.00 175.10 175.95 3d1g n GLY 228 N 4.83 3.39 2.15 4.51 0.00 -1.26 -0.66 105.19 118.15 3d1g n GLY 228 Ca -0.13 -0.04 -0.23 0.00 0.00 0.00 0.00 46.02 45.63 3d1g n GLY 228 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3d1g n ASP 229 N 4.28 3.71 -4.25 1.61 8.00 -1.26 -4.91 116.55 123.73 3d1g n ASP 229 Ca 0.00 -3.63 -0.31 0.00 0.71 0.00 0.00 54.79 51.56 3d1g n ASP 229 Cb 0.00 -0.83 -0.17 0.00 -0.02 0.00 0.00 41.12 40.11 3d1g n ASP 229 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3d1g s PHE 230 N -3.31 2.42 -0.12 1.24 0.08 0.17 -1.79 117.98 116.68 3d1g s PHE 230 Ca 0.56 -0.77 -0.00 0.00 0.12 0.00 0.00 56.93 56.84 3d1g s PHE 230 Cb 0.47 -1.60 0.03 0.00 -0.57 0.00 0.00 43.02 41.35 3d1g s PHE 230 CO 0.10 -0.25 -0.07 0.42 -0.10 0.00 0.00 175.22 175.31 3d1g s ILE 231 N -0.06 1.02 -0.14 0.64 1.01 0.02 -0.91 121.20 122.79 3d1g s ILE 231 Ca -0.06 -0.30 -0.03 0.00 0.00 0.00 0.00 60.65 60.26 3d1g s ILE 231 Cb -0.14 -1.05 -0.03 0.00 0.01 0.00 0.00 42.46 41.25 3d1g s ILE 231 CO 0.05 0.35 -0.04 0.12 0.00 0.00 0.00 174.94 175.42 3d1g s PHE 232 N 1.71 3.02 -0.02 3.97 5.36 0.42 -0.82 117.98 131.62 3d1g s PHE 232 Ca 0.05 -0.24 0.03 0.00 -0.96 0.00 0.00 56.93 55.81 3d1g s PHE 232 Cb -0.13 -1.91 -0.00 0.00 -0.34 0.00 0.00 43.02 40.64 3d1g s PHE 232 CO -0.08 0.04 -0.12 0.99 -1.46 0.00 0.00 175.22 174.59 3d1g s THR 233 N 0.13 0.96 0.00 0.12 2.01 0.14 -0.60 115.64 118.41 3d1g s THR 233 Ca -0.01 -0.49 -0.04 0.00 0.31 0.00 0.00 61.69 61.46 3d1g s THR 233 Cb -0.14 -0.82 -0.01 0.00 0.01 0.00 0.00 72.50 71.55 3d1g s THR 233 CO 0.03 0.28 0.07 -0.55 -0.69 0.00 0.00 174.62 173.75 3d1g s SER 234 N -0.09 0.09 0.65 3.53 0.15 -0.25 -0.14 113.70 117.64 3d1g s SER 234 Ca 0.01 -0.25 -0.12 0.00 0.70 0.00 0.00 55.95 56.29 3d1g s SER 234 Cb -0.07 0.16 -0.01 0.00 -1.71 0.00 0.00 66.02 64.39 3d1g s SER 234 CO 0.00 -0.28 1.05 -0.54 1.20 0.00 0.00 173.24 174.67 3d1g s LYS 235 N -1.16 3.16 0.33 5.44 -0.14 -0.74 -1.23 119.74 125.40 3d1g s LYS 235 Ca -0.13 1.00 0.07 0.00 -1.36 0.00 0.00 55.97 55.55 3d1g s LYS 235 Cb -0.07 -2.02 -0.01 0.00 -1.68 0.00 0.00 37.83 34.04 3d1g s LYS 235 CO 0.00 -0.92 0.42 -0.51 -0.76 0.00 0.00 175.35 173.58 3d1g s LEU 236 N -5.15 3.92 -0.14 3.17 1.43 -0.63 -4.42 118.68 116.86 3d1g s LEU 236 Ca 0.59 -0.23 -0.15 0.00 -1.03 0.00 0.00 54.13 53.31 3d1g s LEU 236 Cb -0.14 -2.65 -0.04 0.00 0.03 0.00 0.00 46.19 43.39 3d1g s LEU 236 CO 0.49 -0.38 0.36 -0.69 0.23 0.00 0.00 176.35 176.35 3d1g s VAL 237 N -2.18 5.26 -0.49 -1.59 1.01 -0.26 -4.94 120.40 117.21 3d1g s VAL 237 Ca 0.43 0.69 -0.20 0.00 0.00 0.00 0.00 61.98 62.90 3d1g s VAL 237 Cb -0.09 -3.69 0.05 0.00 0.00 0.00 0.00 36.38 32.65 3d1g s VAL 237 CO 0.30 0.37 0.65 -1.81 0.00 0.00 0.00 175.10 174.61 3d1g s ASP 238 N 0.49 6.26 0.02 3.32 1.01 -1.26 -4.41 116.67 122.09 3d1g s ASP 238 Ca 0.20 -0.72 -0.28 0.00 0.71 0.00 0.00 52.55 52.46 3d1g s ASP 238 Cb -0.14 -2.31 0.10 0.00 1.01 0.00 0.00 42.92 41.59 3d1g s ASP 238 CO 0.06 -0.89 1.24 -0.83 0.21 0.00 0.00 175.17 174.96 3d1g s GLY 239 N 2.51 -0.24 -0.61 0.21 0.00 -1.26 -4.90 107.32 103.03 3d1g s GLY 239 Ca 0.18 0.30 -0.17 0.00 0.00 0.00 0.00 44.72 45.03 3d1g s GLY 239 CO 0.14 2.34 0.63 1.09 0.00 0.00 0.00 173.10 177.31 3d1g s ARG 240 N -2.30 3.11 0.23 2.90 1.70 -1.26 -5.01 118.95 118.32 3d1g s ARG 240 Ca 0.20 -1.67 -0.30 0.00 -0.47 0.00 0.00 55.73 53.49 3d1g s ARG 240 Cb 0.02 -4.33 -0.09 0.00 -0.57 0.00 0.00 34.95 29.98 3d1g s ARG 240 CO -0.01 -1.42 1.08 0.12 -1.08 0.00 0.00 175.30 173.99 3d1g s PHE 241 N 1.84 3.63 0.76 5.89 2.19 -1.26 -5.01 117.98 126.02 3d1g s PHE 241 Ca 0.09 1.68 -0.14 0.00 0.33 0.00 0.00 56.93 58.89 3d1g s PHE 241 Cb -0.24 -3.25 0.05 0.00 -1.31 0.00 0.00 43.02 38.27 3d1g s PHE 241 CO 0.02 -0.46 1.20 -1.25 1.83 0.00 0.00 175.22 176.57 3d1g s PRO 242 N -0.97 1.98 -0.37 10.12 0.04 -1.26 -4.98 135.00 139.56 3d1g s PRO 242 Ca 0.46 1.75 -0.21 0.00 0.04 0.00 0.00 61.00 63.04 3d1g s PRO 242 Cb -0.30 -1.82 0.01 0.00 0.04 0.00 0.00 34.50 32.43 3d1g s PRO 242 CO 0.37 -1.96 0.67 0.34 0.04 0.00 0.00 177.00 176.47 3d1g s ASP 243 N -2.10 6.44 0.53 6.66 -1.08 -1.26 -4.93 116.67 120.92 3d1g s ASP 243 Ca 0.74 0.12 0.24 0.00 -0.52 0.00 0.00 52.55 53.13 3d1g s ASP 243 Cb -0.29 -2.34 1.45 0.00 -1.46 0.00 0.00 42.92 40.28 3d1g s ASP 243 CO 0.47 -0.65 2.12 0.10 0.52 0.00 0.00 175.17 177.73 3d1g h TYR 244 N 8.53 0.00 -0.01 -5.34 -0.00 -2.00 -2.00 116.97 116.15 3d1g h TYR 244 Ca -0.26 0.00 -0.02 0.00 -0.00 0.00 0.00 58.73 58.45 3d1g h TYR 244 Cb 1.10 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 37.83 3d1g h TYR 244 CO 0.76 0.08 -0.08 0.00 -0.00 0.00 0.00 178.16 178.92 3d1g h ARG 245 N 0.00 0.01 -0.01 0.10 3.08 -1.94 -0.64 114.38 114.98 3d1g h ARG 245 Ca -0.00 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3d1g h ARG 245 Cb 0.19 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.24 3d1g h ARG 245 CO 0.01 0.10 -0.07 0.54 -1.07 0.00 0.00 179.97 179.47 3d1g n ARG 246 N -4.43 1.40 -0.10 0.04 1.74 -0.75 -3.94 116.66 110.61 3d1g n ARG 246 Ca -0.03 -0.80 -0.12 0.00 -0.77 0.00 0.00 57.85 56.14 3d1g n ARG 246 Cb 0.16 -1.48 -0.13 0.00 -1.02 0.00 0.00 32.46 29.99 3d1g n ARG 246 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3d1g n VAL 247 N -0.11 1.26 -2.01 1.55 0.31 -0.35 -4.95 118.33 114.03 3d1g n VAL 247 Ca 0.17 -0.65 -0.42 0.00 -0.01 0.00 0.00 64.34 63.43 3d1g n VAL 247 Cb 0.35 -0.84 -0.03 0.00 -0.91 0.00 0.00 33.84 32.41 3d1g n VAL 247 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3d1g s LEU 248 N -5.72 4.37 0.56 7.52 2.01 -0.58 -4.94 118.68 121.89 3d1g s LEU 248 Ca -0.18 2.50 -0.20 0.00 0.01 0.00 0.00 54.13 56.26 3d1g s LEU 248 Cb 0.06 -3.59 -0.05 0.00 0.01 0.00 0.00 46.19 42.62 3d1g s LEU 248 CO 0.65 -0.78 1.15 -0.81 1.01 0.00 0.00 176.35 177.57 3d1g n PRO 249 N 4.23 1.27 -3.41 1.29 -0.04 -1.26 -4.96 135.00 132.12 3d1g n PRO 249 Ca 0.13 0.48 -0.40 0.00 -0.04 0.00 0.00 63.50 63.67 3d1g n PRO 249 Cb 0.40 -2.33 -0.09 0.00 -0.04 0.00 0.00 33.50 31.43 3d1g n PRO 249 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 3d1g s LYS 250 N -2.76 3.75 -1.40 0.54 -0.14 -1.26 -4.53 119.74 113.94 3d1g s LYS 250 Ca 0.73 -0.26 -0.11 0.00 -1.36 0.00 0.00 55.97 54.98 3d1g s LYS 250 Cb -0.43 -3.74 0.01 0.00 -1.68 0.00 0.00 37.83 31.99 3d1g s LYS 250 CO 0.48 -0.41 0.32 0.09 -0.76 0.00 0.00 175.35 175.08 3d1g n ASN 251 N 5.34 -1.11 -4.66 2.83 3.02 -1.26 -4.83 115.26 114.59 3d1g n ASN 251 Ca -0.09 -1.21 -0.46 0.00 -0.03 0.00 0.00 54.58 52.79 3d1g n ASN 251 Cb 0.50 -2.03 -0.03 0.00 -0.61 0.00 0.00 39.78 37.61 3d1g n ASN 251 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 3d1g n PRO 252 N -4.65 1.99 0.04 3.52 -0.02 -1.26 -4.90 135.00 129.72 3d1g n PRO 252 Ca -0.25 0.71 0.12 0.00 -2.02 0.00 0.00 63.50 62.06 3d1g n PRO 252 Cb 0.65 -2.40 0.08 0.00 -0.02 0.00 0.00 33.50 31.81 3d1g n PRO 252 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3d1g n ASP 253 N 2.61 0.64 -4.37 2.55 5.75 -1.16 -4.81 116.55 117.76 3d1g n ASP 253 Ca 0.14 -0.07 -0.38 0.00 -0.01 0.00 0.00 54.79 54.48 3d1g n ASP 253 Cb 0.30 0.56 -0.12 0.00 -1.03 0.00 0.00 41.12 40.82 3d1g n ASP 253 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 3d1g s LYS 254 N -3.19 3.12 -0.15 0.11 1.02 -0.54 -4.97 119.74 115.13 3d1g s LYS 254 Ca 0.04 -0.85 0.00 0.00 0.02 0.00 0.00 55.97 55.18 3d1g s LYS 254 Cb 0.14 -3.45 -0.00 0.00 -0.52 0.00 0.00 37.83 33.99 3d1g s LYS 254 CO 0.77 -0.46 -0.15 -1.01 -0.92 0.00 0.00 175.35 173.58 3d1g s HIS 255 N 1.53 2.79 -0.05 3.18 3.76 -1.26 -0.24 115.29 125.00 3d1g s HIS 255 Ca 0.03 -0.99 0.06 0.00 -0.15 0.00 0.00 55.06 54.01 3d1g s HIS 255 Cb -0.17 -1.89 -0.01 0.00 1.11 0.00 0.00 32.58 31.61 3d1g s HIS 255 CO 0.04 -0.44 -0.25 -1.17 -0.85 0.00 0.00 174.74 172.07 3d1g s LEU 256 N 0.78 2.06 -0.02 0.89 0.20 -0.01 -4.55 118.68 118.04 3d1g s LEU 256 Ca -0.06 -0.49 0.05 0.00 0.69 0.00 0.00 54.13 54.32 3d1g s LEU 256 Cb -0.15 -1.34 -0.01 0.00 -0.43 0.00 0.00 46.19 44.26 3d1g s LEU 256 CO 0.01 0.25 -0.17 -0.70 -0.29 0.00 0.00 176.35 175.44 3d1g s GLU 257 N -0.23 1.45 0.15 1.98 2.12 -0.42 -0.43 118.70 123.32 3d1g s GLU 257 Ca -0.01 -0.62 -0.18 0.00 0.36 0.00 0.00 54.97 54.52 3d1g s GLU 257 Cb -0.13 -1.38 0.04 0.00 0.26 0.00 0.00 34.13 32.92 3d1g s GLU 257 CO 0.03 0.36 0.47 0.00 -0.54 0.00 0.00 175.26 175.58 3d1g s ALA 258 N -0.36 -1.07 0.25 6.30 0.00 -0.62 -0.88 121.76 125.39 3d1g s ALA 258 Ca 0.06 0.02 -0.30 0.00 0.00 0.00 0.00 51.96 51.74 3d1g s ALA 258 Cb -0.07 0.77 -0.10 0.00 0.00 0.00 0.00 23.12 23.72 3d1g s ALA 258 CO -0.00 -0.71 1.48 0.20 0.00 0.00 0.00 175.76 176.73 3d1g s GLY 259 N -2.81 2.21 0.10 0.00 0.00 -1.26 -0.53 107.32 105.03 3d1g s GLY 259 Ca 0.04 1.38 -0.23 0.00 0.00 0.00 0.00 44.72 45.91 3d1g s GLY 259 CO -0.10 2.36 1.72 0.00 0.00 0.00 0.00 173.10 177.08 3d1g h ASP 261 N -0.09 -0.09 -0.66 0.00 3.58 -1.85 0.48 116.42 117.78 3d1g h ASP 261 Ca 0.02 0.04 -0.01 0.00 0.42 0.00 0.00 57.03 57.50 3d1g h ASP 261 Cb 0.12 0.07 -0.03 0.00 1.72 0.00 0.00 39.33 41.21 3d1g h ASP 261 CO -0.05 -0.02 0.38 -0.07 -2.88 0.00 0.00 179.24 176.59 3d1g h LEU 262 N 0.03 0.82 -0.28 2.28 3.38 -1.93 0.37 115.31 119.98 3d1g h LEU 262 Ca 0.07 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 3d1g h LEU 262 Cb 0.09 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 3d1g h LEU 262 CO -0.13 0.67 0.05 0.25 0.09 0.00 0.00 178.44 179.37 3d1g h LEU 263 N 0.91 0.44 -0.22 1.67 5.85 -1.03 -2.14 115.31 120.79 3d1g h LEU 263 Ca 0.24 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.71 3d1g h LEU 263 Cb 0.02 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 3d1g h LEU 263 CO -0.04 0.57 0.14 0.50 -0.34 0.00 0.00 178.44 179.28 3d1g h LYS 264 N 0.28 0.30 -0.14 1.25 3.64 -0.61 -1.31 116.57 119.98 3d1g h LYS 264 Ca 0.09 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.38 3d1g h LYS 264 Cb 0.32 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 3d1g h LYS 264 CO 0.00 0.21 -0.22 1.96 -2.27 0.00 0.00 179.45 179.13 3d1g h GLN 265 N 0.29 0.23 -0.07 1.90 1.08 -0.91 0.15 115.11 117.79 3d1g h GLN 265 Ca 0.08 -0.07 -0.01 0.00 -1.45 0.00 0.00 58.65 57.20 3d1g h GLN 265 Cb -0.02 -0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 27.38 3d1g h GLN 265 CO -0.02 0.45 -0.00 0.00 -0.95 0.00 0.00 178.83 178.31 3d1g h ALA 266 N 1.56 0.10 -0.66 3.87 0.00 -0.99 -0.92 119.26 122.21 3d1g h ALA 266 Ca 0.04 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 3d1g h ALA 266 Cb 0.52 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 3d1g h ALA 266 CO 0.04 -0.23 0.20 0.74 0.00 0.00 0.00 179.25 180.00 3d1g h PHE 267 N -0.16 1.05 -0.66 0.00 0.04 -1.01 -1.58 116.94 114.61 3d1g h PHE 267 Ca 0.02 -0.10 -0.02 0.00 2.80 0.00 0.00 57.97 60.68 3d1g h PHE 267 Cb 0.34 -0.31 -0.03 0.00 2.20 0.00 0.00 35.95 38.15 3d1g h PHE 267 CO 0.03 0.84 0.35 0.00 -0.60 0.00 0.00 178.31 178.93 3d1g h ALA 268 N 1.24 0.85 -0.22 2.45 0.00 -0.54 -0.14 119.26 122.90 3d1g h ALA 268 Ca 0.22 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 3d1g h ALA 268 Cb 0.28 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 3d1g h ALA 268 CO -0.01 0.38 -0.26 0.00 0.00 0.00 0.00 179.25 179.37 3d1g h ARG 269 N 0.91 0.57 -0.84 0.00 3.08 -0.96 -3.12 114.38 114.02 3d1g h ARG 269 Ca 0.23 -0.32 0.00 0.00 0.07 0.00 0.00 59.98 59.97 3d1g h ARG 269 Cb 0.07 0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.10 3d1g h ARG 269 CO -0.03 0.91 0.53 0.00 -1.07 0.00 0.00 179.97 180.31 3d1g h ALA 270 N 0.65 1.35 -0.35 0.04 0.00 -1.15 -2.48 119.26 117.32 3d1g h ALA 270 Ca 0.03 -0.08 0.10 0.00 0.00 0.00 0.00 54.91 54.96 3d1g h ALA 270 Cb 0.83 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 3d1g h ALA 270 CO 0.06 0.58 0.26 0.00 0.00 0.00 0.00 179.25 180.16 3d1g h ALA 271 N 1.44 2.28 -0.78 0.00 0.00 -0.95 -1.68 119.26 119.56 3d1g h ALA 271 Ca 0.30 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.29 3d1g h ALA 271 Cb -0.09 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.67 3d1g h ALA 271 CO -0.06 -0.45 0.51 0.82 0.00 0.00 0.00 179.25 180.08 3d1g h ILE 272 N 0.00 0.96 -0.56 0.00 2.04 -1.47 -1.88 117.51 116.60 3d1g h ILE 272 Ca 0.17 -0.25 -0.11 0.00 1.00 0.00 0.00 64.86 65.66 3d1g h ILE 272 Cb 0.69 0.16 -0.07 0.00 -0.74 0.00 0.00 36.82 36.87 3d1g h ILE 272 CO -0.00 0.13 0.12 0.18 0.00 0.00 0.00 178.15 178.58 3d1g n LEU 273 N -4.50 5.37 -4.95 1.44 4.77 -0.63 -4.97 117.00 113.53 3d1g n LEU 273 Ca 0.13 -3.16 -0.24 0.00 -0.03 0.00 0.00 56.01 52.72 3d1g n LEU 273 Cb 0.31 -0.68 0.01 0.00 -2.33 0.00 0.00 43.42 40.73 3d1g n LEU 273 CO 0.32 0.77 0.31 -0.94 -1.33 0.00 0.00 177.39 176.52 3d1g s SER 274 N -1.31 5.87 0.13 -1.43 1.04 -0.71 -2.58 113.70 114.71 3d1g s SER 274 Ca 0.51 0.37 -0.34 0.00 0.48 0.00 0.00 55.95 56.98 3d1g s SER 274 Cb 0.41 -1.63 -0.13 0.00 0.10 0.00 0.00 66.02 64.77 3d1g s SER 274 CO 0.12 -0.70 1.64 -3.20 0.98 0.00 0.00 173.24 172.08 3d1g n ASN 275 N -2.11 3.24 0.25 7.02 2.85 -1.24 -4.75 115.26 120.52 3d1g n ASN 275 Ca 0.01 1.06 0.10 0.00 -0.11 0.00 0.00 54.58 55.64 3d1g n ASN 275 Cb 0.57 -1.43 0.68 0.00 1.24 0.00 0.00 39.78 40.84 3d1g n ASN 275 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 3d1g h GLU 276 N 6.51 0.00 0.00 1.20 5.08 -1.95 0.35 114.58 125.78 3d1g h GLU 276 Ca -0.45 0.00 -0.38 0.00 -1.00 0.00 0.00 59.36 57.53 3d1g h GLU 276 Cb 1.25 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.43 3d1g h GLU 276 CO 0.90 0.00 -2.41 1.17 -1.00 0.00 0.00 179.01 177.67 3d1g n LYS 277 N -4.43 0.61 0.05 2.33 4.81 -1.26 -4.64 118.16 115.64 3d1g n LYS 277 Ca -0.02 0.15 -0.00 0.00 -0.87 0.00 0.00 58.31 57.56 3d1g n LYS 277 Cb 0.12 -1.49 -0.06 0.00 0.02 0.00 0.00 35.03 33.62 3d1g n LYS 277 CO 0.00 0.00 0.00 0.74 1.17 0.00 0.00 177.40 179.31 3d1g h PHE 278 N -0.06 0.00 -4.44 5.64 0.04 -1.95 -3.49 116.94 112.69 3d1g h PHE 278 Ca -0.56 0.00 -0.35 0.00 2.80 0.00 0.00 57.97 59.87 3d1g h PHE 278 Cb 1.84 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.97 3d1g h PHE 278 CO 0.02 0.61 -0.49 0.54 -0.60 0.00 0.00 178.31 178.39 3d1g n ARG 279 N -3.00 -3.21 -2.72 1.51 5.12 0.12 -4.77 116.66 109.71 3d1g n ARG 279 Ca -0.07 0.68 -0.40 0.00 -1.93 0.00 0.00 57.85 56.12 3d1g n ARG 279 Cb 0.83 -5.38 -0.06 0.00 -1.16 0.00 0.00 32.46 26.69 3d1g n ARG 279 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 3d1g s GLY 280 N -2.42 3.09 0.09 -0.13 0.00 -1.26 -0.50 107.32 106.18 3d1g s GLY 280 Ca 0.21 0.63 0.04 0.00 0.00 0.00 0.00 44.72 45.60 3d1g s GLY 280 CO 0.25 1.27 -0.11 -1.34 0.00 0.00 0.00 173.10 173.17 3d1g s VAL 281 N -0.94 0.98 -0.07 1.40 -7.23 -0.71 -4.50 120.40 109.35 3d1g s VAL 281 Ca 0.42 -1.53 0.02 0.00 -1.81 0.00 0.00 61.98 59.09 3d1g s VAL 281 Cb -0.26 -1.25 -0.03 0.00 0.56 0.00 0.00 36.38 35.40 3d1g s VAL 281 CO 0.32 -0.46 -0.11 -0.13 -0.31 0.00 0.00 175.10 174.41 3d1g s ARG 282 N -2.45 2.71 -0.11 4.82 0.52 -0.03 -1.93 118.95 122.47 3d1g s ARG 282 Ca 0.03 -0.64 -0.00 0.00 -0.52 0.00 0.00 55.73 54.60 3d1g s ARG 282 Cb -0.05 -2.49 -0.02 0.00 0.52 0.00 0.00 34.95 32.90 3d1g s ARG 282 CO 0.01 0.59 -0.10 -0.51 0.02 0.00 0.00 175.30 175.31 3d1g s LEU 283 N -0.63 2.93 -0.26 2.53 1.02 0.72 -1.20 118.68 123.80 3d1g s LEU 283 Ca 0.09 -0.20 0.03 0.00 0.02 0.00 0.00 54.13 54.07 3d1g s LEU 283 Cb -0.11 -1.66 0.06 0.00 0.02 0.00 0.00 46.19 44.50 3d1g s LEU 283 CO 0.01 0.23 -0.09 -0.31 0.02 0.00 0.00 176.35 176.21 3d1g s TYR 284 N -0.04 3.10 -0.14 0.29 1.51 0.65 -1.45 117.35 121.27 3d1g s TYR 284 Ca -0.02 -2.23 -0.08 0.00 -1.01 0.00 0.00 57.07 53.73 3d1g s TYR 284 Cb -0.14 -1.89 -0.04 0.00 -0.11 0.00 0.00 41.96 39.78 3d1g s TYR 284 CO 0.03 -0.86 0.14 0.14 -1.11 0.00 0.00 175.55 173.90 3d1g s VAL 285 N 1.16 5.47 0.32 0.71 -7.23 -0.35 -1.38 120.40 119.09 3d1g s VAL 285 Ca -0.08 0.22 -0.07 0.00 -1.81 0.00 0.00 61.98 60.25 3d1g s VAL 285 Cb -0.20 -3.43 0.01 0.00 0.56 0.00 0.00 36.38 33.32 3d1g s VAL 285 CO -0.05 0.57 0.50 -0.94 -0.31 0.00 0.00 175.10 174.86 3d1g s SER 286 N -0.62 0.52 -0.46 4.85 1.04 -0.61 -2.51 113.70 115.91 3d1g s SER 286 Ca 0.13 -1.30 -0.40 0.00 0.48 0.00 0.00 55.95 54.86 3d1g s SER 286 Cb -0.12 0.66 -0.16 0.00 0.10 0.00 0.00 66.02 66.50 3d1g s SER 286 CO 0.03 -1.29 2.17 1.21 0.98 0.00 0.00 173.24 176.34 3d1g n GLU 287 N -0.50 0.40 -3.15 4.02 2.13 -1.26 -0.95 120.64 121.32 3d1g n GLU 287 Ca -0.01 0.11 -0.20 0.00 0.66 0.00 0.00 57.16 57.72 3d1g n GLU 287 Cb 0.62 -1.86 -0.01 0.00 0.27 0.00 0.00 31.44 30.46 3d1g n GLU 287 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 3d1g n ASN 288 N 8.48 -3.46 -3.77 4.31 3.02 0.13 -4.94 115.26 119.03 3d1g n ASN 288 Ca 0.50 -0.23 -0.13 0.00 -0.03 0.00 0.00 54.58 54.69 3d1g n ASN 288 Cb 0.06 -2.90 -0.10 0.00 -0.61 0.00 0.00 39.78 36.24 3d1g n ASN 288 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 3d1g s GLN 289 N -5.78 0.51 -0.05 3.52 0.74 -0.13 -2.40 119.66 116.07 3d1g s GLN 289 Ca 0.30 0.13 0.02 0.00 0.05 0.00 0.00 55.36 55.86 3d1g s GLN 289 Cb -0.16 0.23 0.02 0.00 1.10 0.00 0.00 33.01 34.20 3d1g s GLN 289 CO 0.37 -0.11 -0.09 -1.17 -0.55 0.00 0.00 175.29 173.74 3d1g s LEU 290 N -0.55 1.55 -0.11 3.68 2.96 -0.66 -1.57 118.68 123.98 3d1g s LEU 290 Ca -0.07 -0.23 0.03 0.00 -0.22 0.00 0.00 54.13 53.64 3d1g s LEU 290 Cb -0.04 -0.68 -0.00 0.00 0.50 0.00 0.00 46.19 45.97 3d1g s LEU 290 CO 0.02 0.01 -0.22 -0.75 -1.32 0.00 0.00 176.35 174.09 3d1g s LYS 291 N 0.70 3.11 -0.13 1.98 2.20 -0.48 -1.05 119.74 126.08 3d1g s LYS 291 Ca -0.13 -0.84 0.02 0.00 -0.36 0.00 0.00 55.97 54.66 3d1g s LYS 291 Cb -0.15 -2.38 -0.01 0.00 -1.51 0.00 0.00 37.83 33.78 3d1g s LYS 291 CO 0.02 0.16 -0.18 0.42 -0.36 0.00 0.00 175.35 175.42 3d1g s ILE 292 N 0.41 2.56 0.17 5.43 1.01 -0.02 -0.26 121.20 130.49 3d1g s ILE 292 Ca -0.16 -0.83 0.07 0.00 0.00 0.00 0.00 60.65 59.74 3d1g s ILE 292 Cb -0.17 -2.04 -0.04 0.00 0.01 0.00 0.00 42.46 40.21 3d1g s ILE 292 CO 0.07 0.54 -0.16 0.42 0.00 0.00 0.00 174.94 175.81 3d1g s THR 293 N 0.48 1.65 -0.09 2.92 -4.23 -0.34 -0.80 115.64 115.23 3d1g s THR 293 Ca -0.12 -1.97 -0.19 0.00 -1.18 0.00 0.00 61.69 58.23 3d1g s THR 293 Cb -0.16 -1.84 0.04 0.00 1.34 0.00 0.00 72.50 71.88 3d1g s THR 293 CO 0.05 -0.45 0.45 0.00 -0.54 0.00 0.00 174.62 174.13 3d1g s ALA 294 N -2.43 -1.13 0.06 3.99 0.00 -0.77 -0.85 121.76 120.63 3d1g s ALA 294 Ca 0.16 0.93 -0.12 0.00 0.00 0.00 0.00 51.96 52.94 3d1g s ALA 294 Cb -0.04 -0.29 0.01 0.00 0.00 0.00 0.00 23.12 22.80 3d1g s ALA 294 CO 0.06 -0.26 0.27 0.54 0.00 0.00 0.00 175.76 176.36 3d1g s ASN 295 N -0.64 -0.05 0.43 0.00 2.20 -1.17 -1.04 114.94 114.67 3d1g s ASN 295 Ca -0.07 -0.35 0.03 0.00 -0.94 0.00 0.00 52.86 51.53 3d1g s ASN 295 Cb -0.03 0.36 -0.03 0.00 -2.00 0.00 0.00 41.25 39.54 3d1g s ASN 295 CO 0.04 -0.66 0.06 0.54 -2.94 0.00 0.00 177.10 174.13 3d1g s ASN 296 N -2.36 3.33 0.32 3.54 2.20 -1.06 -3.61 114.94 117.30 3d1g s ASN 296 Ca -0.01 -1.57 0.09 0.00 -0.94 0.00 0.00 52.86 50.42 3d1g s ASN 296 Cb 0.01 0.28 0.90 0.00 -2.00 0.00 0.00 41.25 40.44 3d1g s ASN 296 CO -0.06 -0.78 1.71 -0.65 -2.94 0.00 0.00 177.10 174.37 3d1g h PRO 297 N 1.69 0.46 -0.97 3.55 0.11 -1.92 -0.11 132.00 134.82 3d1g h PRO 297 Ca -0.40 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 65.63 3d1g h PRO 297 Cb 1.28 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 32.25 3d1g h PRO 297 CO 0.68 0.31 0.06 -0.85 -0.21 0.00 0.00 178.00 177.99 3d1g n GLU 298 N -4.96 1.44 -1.98 1.05 0.00 -1.26 -4.86 120.64 110.07 3d1g n GLU 298 Ca 0.27 -0.55 -0.18 0.00 0.00 0.00 0.00 57.16 56.69 3d1g n GLU 298 Cb 0.78 -1.41 -0.04 0.00 0.00 0.00 0.00 31.44 30.77 3d1g n GLU 298 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 3d1g n GLN 299 N 0.16 -1.63 -2.84 3.44 3.00 -0.05 -4.98 117.38 114.49 3d1g n GLN 299 Ca 0.08 0.99 -0.34 0.00 -0.01 0.00 0.00 57.00 57.72 3d1g n GLN 299 Cb 0.58 -5.49 -0.07 0.00 0.00 0.00 0.00 30.24 25.26 3d1g n GLN 299 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 3d1g s GLU 300 N -4.31 4.28 0.01 -1.09 2.02 -1.26 -4.87 118.70 113.48 3d1g s GLU 300 Ca 0.00 1.13 0.01 0.00 0.02 0.00 0.00 54.97 56.13 3d1g s GLU 300 Cb 0.00 -2.33 -0.01 0.00 0.10 0.00 0.00 34.13 31.89 3d1g s GLU 300 CO 0.00 0.05 -0.04 -1.21 0.02 0.00 0.00 175.26 174.08 3d1g s GLU 301 N -2.93 0.29 0.04 1.61 2.02 -1.26 -2.56 118.70 115.90 3d1g s GLU 301 Ca 0.59 -0.34 0.06 0.00 0.02 0.00 0.00 54.97 55.30 3d1g s GLU 301 Cb -0.11 -0.14 -0.02 0.00 0.10 0.00 0.00 34.13 33.95 3d1g s GLU 301 CO 0.15 0.03 -0.18 0.00 0.02 0.00 0.00 175.26 175.28 3d1g s ALA 302 N -0.64 1.53 -0.06 5.21 0.00 -0.21 -4.99 121.76 122.60 3d1g s ALA 302 Ca -0.05 -0.95 -0.02 0.00 0.00 0.00 0.00 51.96 50.94 3d1g s ALA 302 Cb -0.05 -0.29 0.04 0.00 0.00 0.00 0.00 23.12 22.82 3d1g s ALA 302 CO -0.00 0.33 0.12 -2.00 0.00 0.00 0.00 175.76 174.21 3d1g s GLU 303 N -1.08 0.06 -0.06 0.00 2.12 -1.26 -1.85 118.70 116.64 3d1g s GLU 303 Ca 0.05 0.34 0.04 0.00 0.36 0.00 0.00 54.97 55.76 3d1g s GLU 303 Cb -0.08 -0.20 0.00 0.00 0.26 0.00 0.00 34.13 34.11 3d1g s GLU 303 CO 0.01 -0.17 -0.17 -1.21 -0.54 0.00 0.00 175.26 173.18 3d1g s GLU 304 N 1.20 1.96 -0.09 4.30 0.41 0.02 -4.99 118.70 121.50 3d1g s GLU 304 Ca -0.09 -0.60 0.04 0.00 -0.41 0.00 0.00 54.97 53.92 3d1g s GLU 304 Cb -0.12 -1.63 -0.00 0.00 -1.78 0.00 0.00 34.13 30.60 3d1g s GLU 304 CO -0.05 0.18 -0.23 0.42 -0.49 0.00 0.00 175.26 175.08 3d1g s ILE 305 N 0.26 2.13 0.06 -1.63 1.01 -1.26 -0.84 121.20 120.92 3d1g s ILE 305 Ca -0.09 -1.00 0.04 0.00 0.00 0.00 0.00 60.65 59.60 3d1g s ILE 305 Cb -0.14 -1.81 -0.03 0.00 0.01 0.00 0.00 42.46 40.50 3d1g s ILE 305 CO 0.04 0.56 -0.12 -0.76 0.00 0.00 0.00 174.94 174.65 3d1g s LEU 306 N 0.23 2.26 0.01 2.97 1.43 -0.22 -5.01 118.68 120.37 3d1g s LEU 306 Ca -0.15 -0.59 -0.23 0.00 -1.03 0.00 0.00 54.13 52.14 3d1g s LEU 306 Cb -0.17 -0.42 -0.05 0.00 0.03 0.00 0.00 46.19 45.57 3d1g s LEU 306 CO 0.08 -0.10 0.67 -1.81 0.23 0.00 0.00 176.35 175.41 3d1g s ASP 307 N -1.65 7.08 0.33 2.29 1.01 -1.26 -1.65 116.67 122.81 3d1g s ASP 307 Ca -0.04 1.28 0.04 0.00 0.71 0.00 0.00 52.55 54.55 3d1g s ASP 307 Cb -0.10 -2.41 -0.02 0.00 1.01 0.00 0.00 42.92 41.40 3d1g s ASP 307 CO 0.02 0.06 0.33 0.68 0.21 0.00 0.00 175.17 176.46 3d1g s VAL 308 N -0.09 0.00 -0.31 -1.27 -7.23 -1.01 -4.85 120.40 105.64 3d1g s VAL 308 Ca 0.34 -1.89 -0.07 0.00 -1.81 0.00 0.00 61.98 58.56 3d1g s VAL 308 Cb -0.19 -2.54 0.02 0.00 0.56 0.00 0.00 36.38 34.23 3d1g s VAL 308 CO 0.20 0.00 0.09 -0.89 -0.31 0.00 0.00 175.10 174.18 3d1g s THR 309 N -3.36 3.91 -0.28 5.32 2.01 -0.06 -4.24 115.64 118.93 3d1g s THR 309 Ca 0.38 -0.83 -0.17 0.00 0.31 0.00 0.00 61.69 61.38 3d1g s THR 309 Cb 0.02 -3.08 0.09 0.00 0.01 0.00 0.00 72.50 69.54 3d1g s THR 309 CO 0.25 -0.00 0.74 -0.47 -0.69 0.00 0.00 174.62 174.44 3d1g s TYR 310 N 1.47 -0.98 -0.04 4.92 5.04 -1.26 -1.31 117.35 125.20 3d1g s TYR 310 Ca 0.01 1.97 0.06 0.00 -2.44 0.00 0.00 57.07 56.67 3d1g s TYR 310 Cb -0.18 0.58 0.09 0.00 0.35 0.00 0.00 41.96 42.79 3d1g s TYR 310 CO 0.03 -0.48 0.94 0.43 -1.34 0.00 0.00 175.55 175.12 3d1g n SER 311 N 4.13 1.20 -4.19 4.32 7.64 -1.26 -0.69 113.62 124.77 3d1g n SER 311 Ca -0.19 -2.11 -0.29 0.00 1.01 0.00 0.00 58.87 57.28 3d1g n SER 311 Cb 0.59 -0.18 0.18 0.00 -1.01 0.00 0.00 64.21 63.79 3d1g n SER 311 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3d1g s GLY 312 N -1.35 1.78 0.70 0.23 0.00 -1.26 -5.01 107.32 102.41 3d1g s GLY 312 Ca 0.09 -1.23 -0.15 0.00 0.00 0.00 0.00 44.72 43.43 3d1g s GLY 312 CO 0.01 -0.48 1.18 0.00 0.00 0.00 0.00 173.10 173.81 3d1g s ALA 313 N -3.83 2.25 0.44 3.20 0.00 -1.26 -4.68 121.76 117.88 3d1g s ALA 313 Ca 0.73 0.79 -0.24 0.00 0.00 0.00 0.00 51.96 53.24 3d1g s ALA 313 Cb -0.04 -3.42 -0.08 0.00 0.00 0.00 0.00 23.12 19.58 3d1g s ALA 313 CO 0.52 -1.64 1.23 -1.21 0.00 0.00 0.00 175.76 174.66 3d1g s GLU 314 N -3.92 3.81 -0.04 0.00 2.02 -1.26 -4.82 118.70 114.49 3d1g s GLU 314 Ca 0.72 1.95 -0.29 0.00 0.02 0.00 0.00 54.97 57.37 3d1g s GLU 314 Cb -0.26 -2.55 0.09 0.00 0.10 0.00 0.00 34.13 31.51 3d1g s GLU 314 CO 0.43 -0.56 0.77 1.41 0.02 0.00 0.00 175.26 177.33 3d1g s MET 315 N -2.50 0.94 0.00 1.61 1.75 -1.05 -5.01 119.30 115.05 3d1g s MET 315 Ca 0.61 0.05 0.08 0.00 -1.25 0.00 0.00 55.69 55.18 3d1g s MET 315 Cb -0.33 0.44 -0.02 0.00 2.84 0.00 0.00 34.83 37.76 3d1g s MET 315 CO 0.41 -0.33 -0.26 -1.21 -0.65 0.00 0.00 175.02 172.98 3d1g s GLU 316 N -1.80 1.97 -0.11 4.11 2.02 -1.26 -1.21 118.70 122.41 3d1g s GLU 316 Ca -0.05 -0.97 -0.25 0.00 0.02 0.00 0.00 54.97 53.73 3d1g s GLU 316 Cb -0.00 -1.98 0.06 0.00 0.10 0.00 0.00 34.13 32.31 3d1g s GLU 316 CO 0.02 0.53 0.59 -1.50 0.02 0.00 0.00 175.26 174.92 3d1g s ILE 317 N -0.66 0.01 0.14 -1.63 2.07 -0.53 -4.65 121.20 115.95 3d1g s ILE 317 Ca 0.10 -0.08 0.06 0.00 -1.41 0.00 0.00 60.65 59.32 3d1g s ILE 317 Cb -0.10 -0.88 -0.04 0.00 0.13 0.00 0.00 42.46 41.57 3d1g s ILE 317 CO -0.00 -0.05 0.03 -0.83 -1.91 0.00 0.00 174.94 172.19 3d1g s GLY 318 N -0.64 1.79 0.03 1.50 0.00 -1.25 -0.20 107.32 108.55 3d1g s GLY 318 Ca -0.07 -1.24 -0.17 0.00 0.00 0.00 0.00 44.72 43.24 3d1g s GLY 318 CO 0.06 -1.25 0.37 -1.36 0.00 0.00 0.00 173.10 170.92 3d1g s PHE 319 N -1.59 -0.22 -0.24 1.90 0.08 -0.81 -0.65 117.98 116.45 3d1g s PHE 319 Ca 0.28 0.18 -0.29 0.00 0.12 0.00 0.00 56.93 57.22 3d1g s PHE 319 Cb -0.10 0.17 -0.01 0.00 -0.57 0.00 0.00 43.02 42.51 3d1g s PHE 319 CO 0.20 -0.53 1.36 1.21 -0.10 0.00 0.00 175.22 177.36 3d1g s ASN 320 N -1.91 6.70 0.52 1.36 3.84 -1.26 -1.73 114.94 122.46 3d1g s ASN 320 Ca -0.06 1.47 0.26 0.00 0.21 0.00 0.00 52.86 54.73 3d1g s ASN 320 Cb -0.01 -2.54 1.44 0.00 -0.55 0.00 0.00 41.25 39.59 3d1g s ASN 320 CO -0.01 -1.01 2.09 1.62 -2.79 0.00 0.00 177.10 176.99 3d1g h VAL 321 N 5.84 0.64 -0.67 -5.21 3.04 -1.10 -2.37 116.25 116.42 3d1g h VAL 321 Ca -0.28 -0.48 -0.08 0.00 -1.01 0.00 0.00 66.70 64.85 3d1g h VAL 321 Cb 1.11 1.30 -0.03 0.00 -2.01 0.00 0.00 31.29 31.66 3d1g h VAL 321 CO 1.01 0.11 0.10 0.28 -1.01 0.00 0.00 177.57 178.06 3d1g h SER 322 N 0.00 1.07 -0.61 3.17 0.02 -1.90 0.12 113.55 115.41 3d1g h SER 322 Ca -0.00 -0.26 -0.10 0.00 -0.84 0.00 0.00 61.79 60.60 3d1g h SER 322 Cb 0.29 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.52 3d1g h SER 322 CO 0.01 1.06 0.01 1.88 -1.14 0.00 0.00 176.83 178.65 3d1g h TYR 323 N 1.04 1.17 -0.08 3.45 0.05 -1.82 0.24 116.97 121.01 3d1g h TYR 323 Ca 0.20 -0.20 -0.01 0.00 0.05 0.00 0.00 58.73 58.77 3d1g h TYR 323 Cb 0.45 -0.31 -0.00 0.00 1.01 0.00 0.00 36.73 37.88 3d1g h TYR 323 CO 0.03 1.02 0.00 0.28 -1.05 0.00 0.00 178.16 178.45 3d1g h VAL 324 N 0.99 1.24 -0.62 -2.88 2.07 -1.32 -2.70 116.25 113.02 3d1g h VAL 324 Ca 0.18 -0.75 -0.01 0.00 0.82 0.00 0.00 66.70 66.93 3d1g h VAL 324 Cb 0.55 1.59 -0.03 0.00 -1.52 0.00 0.00 31.29 31.88 3d1g h VAL 324 CO 0.03 0.21 0.33 -0.07 0.02 0.00 0.00 177.57 178.09 3d1g h LEU 325 N -0.13 0.76 -0.74 2.57 3.38 -0.86 -1.25 115.31 119.03 3d1g h LEU 325 Ca 0.02 -0.06 0.03 0.00 0.09 0.00 0.00 57.88 57.96 3d1g h LEU 325 Cb 0.33 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 3d1g h LEU 325 CO 0.00 0.62 0.47 0.44 0.09 0.00 0.00 178.44 180.07 3d1g h ASP 326 N 0.86 0.79 -0.17 -0.43 3.32 -0.79 0.73 116.42 120.73 3d1g h ASP 326 Ca 0.22 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.23 3d1g h ASP 326 Cb 0.03 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 3d1g h ASP 326 CO -0.03 0.55 -0.04 0.58 -1.72 0.00 0.00 179.24 178.58 3d1g h VAL 327 N 0.93 1.28 -0.05 -1.35 2.07 -1.07 -1.90 116.25 116.16 3d1g h VAL 327 Ca 0.29 -0.99 -0.04 0.00 0.82 0.00 0.00 66.70 66.79 3d1g h VAL 327 Cb -0.01 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 3d1g h VAL 327 CO -0.10 0.29 -0.14 -0.07 0.02 0.00 0.00 177.57 177.57 3d1g h LEU 328 N 0.03 0.07 -0.38 2.57 3.38 -0.93 -1.57 115.31 118.49 3d1g h LEU 328 Ca 0.04 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.89 3d1g h LEU 328 Cb 0.47 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 3d1g h LEU 328 CO 0.02 0.22 -0.55 0.78 0.09 0.00 0.00 178.44 178.99 3d1g h ASN 329 N 0.07 0.00 0.84 -0.43 -0.26 -0.77 -3.18 115.58 111.85 3d1g h ASN 329 Ca 0.01 0.00 -0.19 0.00 -0.56 0.00 0.00 56.30 55.56 3d1g h ASN 329 Cb 0.30 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.54 3d1g h ASN 329 CO 0.02 0.55 -0.91 0.00 -1.06 0.00 0.00 177.43 176.03 3d1g h ALA 330 N 1.45 0.50 -2.69 -0.83 0.00 -0.48 -3.43 119.26 113.78 3d1g h ALA 330 Ca -0.01 -0.81 -0.54 0.00 0.00 0.00 0.00 54.91 53.56 3d1g h ALA 330 Cb 1.26 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.89 3d1g h ALA 330 CO 0.07 1.08 0.14 -0.51 0.00 0.00 0.00 179.25 180.03 3d1g s LEU 331 N -7.03 4.48 -0.20 0.00 1.43 -0.71 -4.91 118.68 111.73 3d1g s LEU 331 Ca -0.00 1.46 0.12 0.00 -1.03 0.00 0.00 54.13 54.67 3d1g s LEU 331 Cb 0.10 -3.20 0.42 0.00 0.03 0.00 0.00 46.19 43.54 3d1g s LEU 331 CO 0.81 0.07 1.22 1.17 0.23 0.00 0.00 176.35 179.85 3d1g n LYS 332 N 2.50 1.60 -2.72 1.70 3.00 -1.26 -4.89 118.16 118.09 3d1g n LYS 332 Ca -0.04 -3.28 -0.21 0.00 -0.00 0.00 0.00 58.31 54.78 3d1g n LYS 332 Cb 0.50 -1.57 0.05 0.00 0.00 0.00 0.00 35.03 34.02 3d1g n LYS 332 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3d1g h GLU 334 N 0.02 0.28 -5.74 0.00 4.81 -1.97 -3.42 114.58 108.57 3d1g h GLU 334 Ca -0.39 -0.33 -0.51 0.00 -0.13 0.00 0.00 59.36 58.00 3d1g h GLU 334 Cb 1.29 0.10 -0.24 0.00 0.63 0.00 0.00 28.75 30.52 3d1g h GLU 334 CO 0.47 1.05 -0.82 -0.80 -0.73 0.00 0.00 179.01 178.19 3d1g s ASN 335 N -6.59 2.10 0.11 1.04 0.01 -1.26 -0.74 114.94 109.61 3d1g s ASN 335 Ca -0.15 -0.53 0.10 0.00 -0.71 0.00 0.00 52.86 51.58 3d1g s ASN 335 Cb 0.02 -0.14 -0.04 0.00 0.41 0.00 0.00 41.25 41.49 3d1g s ASN 335 CO 0.79 0.08 -0.26 -0.69 -1.51 0.00 0.00 177.10 175.50 3d1g s VAL 336 N -0.90 2.31 -0.08 1.60 1.01 0.31 -1.41 120.40 123.24 3d1g s VAL 336 Ca 0.04 -1.67 0.04 0.00 0.00 0.00 0.00 61.98 60.40 3d1g s VAL 336 Cb -0.09 -2.01 -0.00 0.00 0.00 0.00 0.00 36.38 34.28 3d1g s VAL 336 CO 0.02 0.14 -0.23 -0.60 0.00 0.00 0.00 175.10 174.43 3d1g s ARG 337 N -1.94 2.71 -0.13 2.72 3.52 0.13 -1.58 118.95 124.37 3d1g s ARG 337 Ca 0.14 -0.83 -0.00 0.00 -0.13 0.00 0.00 55.73 54.91 3d1g s ARG 337 Cb -0.10 -2.13 -0.02 0.00 -1.56 0.00 0.00 34.95 31.14 3d1g s ARG 337 CO 0.06 0.23 -0.13 -1.64 -0.81 0.00 0.00 175.30 173.01 3d1g s MET 338 N 0.20 3.38 -0.12 5.12 -1.94 0.42 -1.48 119.30 124.88 3d1g s MET 338 Ca -0.13 -0.68 0.02 0.00 -1.71 0.00 0.00 55.69 53.19 3d1g s MET 338 Cb -0.16 -2.64 -0.00 0.00 2.01 0.00 0.00 34.83 34.04 3d1g s MET 338 CO 0.07 0.23 -0.20 -1.64 -0.01 0.00 0.00 175.02 173.46 3d1g s MET 339 N 0.32 3.15 0.23 2.03 -1.94 0.89 -0.83 119.30 123.16 3d1g s MET 339 Ca -0.10 -0.81 0.07 0.00 -1.71 0.00 0.00 55.69 53.13 3d1g s MET 339 Cb -0.16 -2.45 -0.05 0.00 2.01 0.00 0.00 34.83 34.19 3d1g s MET 339 CO 0.06 0.13 -0.09 -0.51 -0.01 0.00 0.00 175.02 174.59 3d1g s LEU 340 N 0.49 2.49 0.08 -0.03 1.43 0.67 -1.17 118.68 122.64 3d1g s LEU 340 Ca -0.13 -1.10 0.00 0.00 -1.03 0.00 0.00 54.13 51.86 3d1g s LEU 340 Cb -0.17 -0.59 0.00 0.00 0.03 0.00 0.00 46.19 45.46 3d1g s LEU 340 CO 0.05 -0.28 0.00 0.35 0.23 0.00 0.00 176.35 176.70 3d1g n THR 341 N -0.44 0.91 -3.99 5.49 -2.24 -1.26 -1.47 114.28 111.27 3d1g n THR 341 Ca -0.07 0.30 -0.13 0.00 -2.27 0.00 0.00 64.05 61.88 3d1g n THR 341 Cb 0.62 -1.53 -0.01 0.00 -2.10 0.00 0.00 70.33 67.31 3d1g n THR 341 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 3d1g s ASP 342 N -5.73 0.72 0.39 3.42 1.47 -1.26 -4.87 116.67 110.81 3d1g s ASP 342 Ca 0.00 -1.43 0.28 0.00 1.18 0.00 0.00 52.55 52.58 3d1g s ASP 342 Cb 0.00 0.75 1.31 0.00 -0.34 0.00 0.00 42.92 44.64 3d1g s ASP 342 CO 0.00 -1.47 1.85 0.28 0.68 0.00 0.00 175.17 176.50 3d1g h SER 343 N 2.04 0.00 -0.09 2.11 0.02 -2.00 -3.00 113.55 112.63 3d1g h SER 343 Ca -0.30 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.65 3d1g h SER 343 Cb 1.24 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.78 3d1g h SER 343 CO 0.40 0.00 -0.02 1.33 -1.14 0.00 0.00 176.83 177.40 3d1g n VAL 344 N -2.54 2.04 -4.41 2.27 0.24 -1.26 -4.77 118.33 109.90 3d1g n VAL 344 Ca 0.00 -2.20 -0.21 0.00 -2.04 0.00 0.00 64.34 59.89 3d1g n VAL 344 Cb 0.17 -0.25 -0.10 0.00 -1.47 0.00 0.00 33.84 32.19 3d1g n VAL 344 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 3d1g s SER 345 N -2.60 2.94 0.80 -1.34 0.01 -1.14 -4.90 113.70 107.48 3d1g s SER 345 Ca 0.36 -1.09 -0.11 0.00 1.31 0.00 0.00 55.95 56.42 3d1g s SER 345 Cb 0.31 -0.20 0.07 0.00 0.21 0.00 0.00 66.02 66.41 3d1g s SER 345 CO 0.04 -0.19 1.09 -0.44 0.41 0.00 0.00 173.24 174.16 3d1g s SER 346 N -3.42 4.29 0.02 2.44 0.01 -1.26 -4.34 113.70 111.43 3d1g s SER 346 Ca 0.27 1.81 0.03 0.00 1.31 0.00 0.00 55.95 59.37 3d1g s SER 346 Cb 0.00 -2.48 -0.04 0.00 0.21 0.00 0.00 66.02 63.71 3d1g s SER 346 CO 0.11 -2.17 -0.04 0.54 0.41 0.00 0.00 173.24 172.09 3d1g s VAL 347 N -2.89 3.85 -0.12 3.43 0.11 -0.62 -4.53 120.40 119.63 3d1g s VAL 347 Ca 0.62 -0.77 -0.02 0.00 -2.93 0.00 0.00 61.98 58.87 3d1g s VAL 347 Cb -0.18 -2.72 -0.03 0.00 -1.53 0.00 0.00 36.38 31.93 3d1g s VAL 347 CO 0.56 0.34 -0.04 -1.58 -3.33 0.00 0.00 175.10 171.05 3d1g s GLN 348 N -1.63 3.31 -0.03 1.54 0.74 -0.31 -1.39 119.66 121.90 3d1g s GLN 348 Ca 0.19 -0.51 0.06 0.00 0.05 0.00 0.00 55.36 55.15 3d1g s GLN 348 Cb -0.11 -2.81 -0.01 0.00 1.10 0.00 0.00 33.01 31.18 3d1g s GLN 348 CO 0.10 0.43 -0.21 0.42 -0.55 0.00 0.00 175.29 175.48 3d1g s ILE 349 N -0.16 1.71 0.23 -2.34 1.01 0.91 -0.07 121.20 122.49 3d1g s ILE 349 Ca 0.03 -0.91 -0.22 0.00 0.00 0.00 0.00 60.65 59.55 3d1g s ILE 349 Cb -0.13 -1.44 0.04 0.00 0.01 0.00 0.00 42.46 40.94 3d1g s ILE 349 CO 0.02 0.48 0.67 -1.83 0.00 0.00 0.00 174.94 174.29 3d1g s GLU 350 N -0.34 1.59 0.11 2.79 -1.05 -0.55 -1.45 118.70 119.80 3d1g s GLU 350 Ca 0.04 -0.78 -0.31 0.00 -0.15 0.00 0.00 54.97 53.77 3d1g s GLU 350 Cb -0.10 0.60 -0.08 0.00 -0.44 0.00 0.00 34.13 34.11 3d1g s GLU 350 CO 0.01 -0.72 1.41 0.34 0.95 0.00 0.00 175.26 177.25 3d1g s ASP 351 N -2.85 6.80 0.58 0.83 -1.08 -1.25 -0.69 116.67 119.01 3d1g s ASP 351 Ca 0.07 2.34 0.31 0.00 -0.52 0.00 0.00 52.55 54.75 3d1g s ASP 351 Cb -0.04 -2.58 1.80 0.00 -1.46 0.00 0.00 42.92 40.64 3d1g s ASP 351 CO -0.01 -0.68 2.22 0.00 0.52 0.00 0.00 175.17 177.22 3d1g h ALA 352 N 6.90 1.37 -0.35 3.66 0.00 -1.51 -2.64 119.26 126.70 3d1g h ALA 352 Ca -0.42 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3d1g h ALA 352 Cb 1.21 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.99 3d1g h ALA 352 CO 0.87 0.04 0.00 0.00 0.00 0.00 0.00 179.25 180.16 3d1g n ALA 353 N -2.27 2.35 -3.67 0.00 0.00 -1.26 -4.95 120.51 110.70 3d1g n ALA 353 Ca -0.03 -1.00 -0.09 0.00 0.00 0.00 0.00 53.44 52.32 3d1g n ALA 353 Cb 0.13 -0.65 -0.10 0.00 0.00 0.00 0.00 19.45 18.83 3d1g n ALA 353 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3d1g s SER 354 N -1.17 -0.65 -0.25 0.00 0.15 -0.99 -5.02 113.70 105.77 3d1g s SER 354 Ca 0.30 1.09 0.14 0.00 0.70 0.00 0.00 55.95 58.18 3d1g s SER 354 Cb 0.17 0.97 0.79 0.00 -1.71 0.00 0.00 66.02 66.24 3d1g s SER 354 CO 0.24 -0.21 1.73 0.00 1.20 0.00 0.00 173.24 176.20 3d1g n GLN 355 N 4.27 4.56 0.20 5.44 6.02 -1.26 -3.87 117.38 132.74 3d1g n GLN 355 Ca -0.22 -3.13 0.04 0.00 -0.01 0.00 0.00 57.00 53.67 3d1g n GLN 355 Cb 0.56 -2.22 0.40 0.00 1.02 0.00 0.00 30.24 30.00 3d1g n GLN 355 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.06 176.82 3d1g h SER 356 N 3.60 0.00 -4.45 1.08 0.02 -1.94 -3.44 113.55 108.42 3d1g h SER 356 Ca 0.04 0.00 -0.36 0.00 -0.84 0.00 0.00 61.79 60.62 3d1g h SER 356 Cb 1.99 0.00 -0.20 0.00 0.14 0.00 0.00 62.40 64.33 3d1g h SER 356 CO 0.50 0.33 -0.76 0.00 -1.14 0.00 0.00 176.83 175.77 3d1g s ALA 357 N -4.19 1.10 -0.01 3.77 0.00 -1.26 -1.08 121.76 120.09 3d1g s ALA 357 Ca -0.03 -1.05 -0.04 0.00 0.00 0.00 0.00 51.96 50.85 3d1g s ALA 357 Cb 0.14 -0.04 0.00 0.00 0.00 0.00 0.00 23.12 23.23 3d1g s ALA 357 CO 0.71 0.07 0.08 0.00 0.00 0.00 0.00 175.76 176.62 3d1g s ALA 358 N -1.71 -0.18 -0.01 0.00 0.00 0.17 -4.61 121.76 115.41 3d1g s ALA 358 Ca -0.00 -0.01 0.04 0.00 0.00 0.00 0.00 51.96 52.00 3d1g s ALA 358 Cb -0.07 -0.03 -0.01 0.00 0.00 0.00 0.00 23.12 23.01 3d1g s ALA 358 CO 0.01 -0.11 -0.15 0.71 0.00 0.00 0.00 175.76 176.23 3d1g s TYR 359 N -0.60 1.32 -0.05 0.00 1.51 -0.53 -1.07 117.35 117.93 3d1g s TYR 359 Ca -0.07 -0.26 0.03 0.00 -1.01 0.00 0.00 57.07 55.76 3d1g s TYR 359 Cb -0.04 -0.86 0.01 0.00 -0.11 0.00 0.00 41.96 40.96 3d1g s TYR 359 CO 0.00 -0.03 -0.13 0.08 -1.11 0.00 0.00 175.55 174.36 3d1g s VAL 360 N -0.30 1.17 -0.07 0.71 1.01 -0.34 -0.06 120.40 122.51 3d1g s VAL 360 Ca 0.05 -0.53 0.02 0.00 0.00 0.00 0.00 61.98 61.52 3d1g s VAL 360 Cb -0.06 -1.04 0.01 0.00 0.00 0.00 0.00 36.38 35.29 3d1g s VAL 360 CO -0.00 0.35 -0.14 -0.69 0.00 0.00 0.00 175.10 174.62 3d1g s VAL 361 N 0.39 1.28 0.45 2.92 1.01 -0.48 -0.47 120.40 125.49 3d1g s VAL 361 Ca -0.09 -0.55 -0.23 0.00 0.00 0.00 0.00 61.98 61.10 3d1g s VAL 361 Cb -0.13 -1.16 -0.07 0.00 0.00 0.00 0.00 36.38 35.02 3d1g s VAL 361 CO 0.03 0.39 1.17 0.00 0.00 0.00 0.00 175.10 176.68 3d1g s MET 362 N 0.67 3.79 0.89 2.72 0.23 -0.80 -1.59 119.30 125.20 3d1g s MET 362 Ca -0.14 1.78 -0.12 0.00 -1.03 0.00 0.00 55.69 56.18 3d1g s MET 362 Cb -0.16 -2.43 0.13 0.00 -1.53 0.00 0.00 34.83 30.83 3d1g s MET 362 CO 0.04 -0.53 1.12 -1.25 -2.03 0.00 0.00 175.02 172.37 3d1g s PRO 363 N -2.66 1.31 -0.06 3.16 0.04 -1.26 -4.68 135.00 130.85 3d1g s PRO 363 Ca 0.63 0.44 0.02 0.00 0.04 0.00 0.00 61.00 62.13 3d1g s PRO 363 Cb -0.29 -1.85 0.01 0.00 0.04 0.00 0.00 34.50 32.42 3d1g s PRO 363 CO 0.35 -2.11 -0.12 1.41 0.04 0.00 0.00 177.00 176.56 3d1g s MET 364 N -5.19 1.65 0.34 4.56 1.75 0.18 -4.93 119.30 117.65 3d1g s MET 364 Ca 0.63 -0.42 -0.29 0.00 -1.25 0.00 0.00 55.69 54.36 3d1g s MET 364 Cb -0.15 -1.38 -0.12 0.00 2.84 0.00 0.00 34.83 36.02 3d1g s MET 364 CO 0.54 0.05 1.41 0.54 -0.65 0.00 0.00 175.02 176.92 3d1g n ARG 365 N 3.71 2.40 0.00 4.11 3.00 -1.26 -3.88 116.66 124.74 3d1g n ARG 365 Ca -0.22 0.84 0.00 0.00 -0.01 0.00 0.00 57.85 58.46 3d1g n ARG 365 Cb 0.52 -2.51 0.00 0.00 0.00 0.00 0.00 32.46 30.47 3d1g n ARG 365 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.63 179.10