#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tvv h LEU 2 N 0.00 0.69 -1.44 4.03 5.85 -1.96 -2.37 115.31 120.11 1tvv h LEU 2 Ca 0.00 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.78 1tvv h LEU 2 Cb 0.00 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 40.96 1tvv h LEU 2 CO 0.00 0.31 0.00 -1.84 -0.34 0.00 0.00 178.44 176.57 1tvv n GLU 3 N -4.61 1.97 -0.17 1.25 0.28 -1.26 -4.38 120.64 113.71 1tvv n GLU 3 Ca 0.20 -1.32 -0.02 0.00 -0.16 0.00 0.00 57.16 55.85 1tvv n GLU 3 Cb 0.52 -1.35 0.08 0.00 1.43 0.00 0.00 31.44 32.12 1tvv n GLU 3 CO 0.00 0.00 0.00 0.37 -0.16 0.00 0.00 177.13 177.34 1tvv h GLN 4 N 2.08 0.31 -0.85 3.44 5.75 -1.85 -2.24 115.11 121.74 1tvv h GLN 4 Ca 0.00 -0.02 0.21 0.00 -0.15 0.00 0.00 58.65 58.69 1tvv h GLN 4 Cb 0.57 -0.07 -0.13 0.00 1.07 0.00 0.00 27.48 28.93 1tvv h GLN 4 CO 0.03 0.20 0.29 -1.35 -2.65 0.00 0.00 178.83 175.35 1tvv h PRO 5 N 0.31 0.30 -0.75 -2.39 0.11 -1.85 0.12 132.00 127.86 1tvv h PRO 5 Ca 0.26 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.33 1tvv h PRO 5 Cb 0.33 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 31.34 1tvv h PRO 5 CO -0.30 0.20 0.36 -0.92 -0.21 0.00 0.00 178.00 177.13 1tvv h TYR 6 N 0.31 1.09 -0.41 0.65 3.20 -1.74 0.13 116.97 120.19 1tvv h TYR 6 Ca 0.52 -0.05 -0.03 0.00 3.14 0.00 0.00 58.73 62.30 1tvv h TYR 6 Cb 0.98 -0.34 -0.02 0.00 1.54 0.00 0.00 36.73 38.90 1tvv h TYR 6 CO -0.21 0.80 0.13 -0.07 -1.64 0.00 0.00 178.16 177.17 1tvv h LEU 7 N 1.06 0.60 -0.76 2.82 -0.00 -0.77 -1.10 115.31 117.16 1tvv h LEU 7 Ca 0.26 -0.21 0.02 0.00 -0.00 0.00 0.00 57.88 57.95 1tvv h LEU 7 Cb 0.12 -0.16 -0.04 0.00 -0.00 0.00 0.00 40.66 40.58 1tvv h LEU 7 CO -0.03 0.65 0.50 0.44 -0.00 0.00 0.00 178.44 179.99 1tvv h ASP 8 N 0.53 0.84 -0.72 -0.43 3.32 -0.61 0.37 116.42 119.73 1tvv h ASP 8 Ca 0.13 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.15 1tvv h ASP 8 Cb 0.26 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.58 1tvv h ASP 8 CO -0.00 0.60 0.39 0.25 -1.72 0.00 0.00 179.24 178.75 1tvv h LEU 9 N 1.00 0.90 0.04 1.55 6.46 -0.49 0.28 115.31 125.05 1tvv h LEU 9 Ca 0.29 -0.10 -0.00 0.00 -0.12 0.00 0.00 57.88 57.95 1tvv h LEU 9 Cb -0.07 -0.23 0.00 0.00 -0.73 0.00 0.00 40.66 39.63 1tvv h LEU 9 CO -0.08 0.74 -0.02 0.00 -0.62 0.00 0.00 178.44 178.46 1tvv h ALA 10 N 1.20 -0.05 0.00 1.25 0.00 0.15 -1.05 119.26 120.75 1tvv h ALA 10 Ca 0.25 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.05 1tvv h ALA 10 Cb 0.05 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1tvv h ALA 10 CO -0.04 -0.42 -0.06 -0.22 0.00 0.00 0.00 179.25 178.51 1tvv h LYS 11 N -0.28 -0.11 -0.19 0.00 1.63 -0.22 -2.18 116.57 115.23 1tvv h LYS 11 Ca -0.01 0.01 0.05 0.00 -0.85 0.00 0.00 60.65 59.86 1tvv h LYS 11 Cb 0.26 0.02 -0.07 0.00 -0.60 0.00 0.00 32.23 31.84 1tvv h LYS 11 CO 0.01 -0.07 -0.31 -0.22 -3.45 0.00 0.00 179.45 175.40 1tvv h LYS 12 N -0.11 -0.34 -0.81 1.90 3.64 -0.32 0.37 116.57 120.90 1tvv h LYS 12 Ca 0.03 0.02 0.07 0.00 -1.27 0.00 0.00 60.65 59.49 1tvv h LYS 12 Cb 0.14 0.08 -0.06 0.00 -0.41 0.00 0.00 32.23 31.98 1tvv h LYS 12 CO -0.06 -0.23 0.49 0.28 -2.27 0.00 0.00 179.45 177.65 1tvv h VAL 13 N -0.36 1.00 -0.51 2.00 2.07 -1.06 0.34 116.25 119.73 1tvv h VAL 13 Ca 0.11 -0.30 0.03 0.00 0.82 0.00 0.00 66.70 67.36 1tvv h VAL 13 Cb 0.53 0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 30.33 1tvv h VAL 13 CO -0.39 0.16 0.34 -0.07 0.02 0.00 0.00 177.57 177.63 1tvv h LEU 14 N 0.88 0.51 0.14 2.57 3.38 -0.47 0.28 115.31 122.59 1tvv h LEU 14 Ca 0.36 -0.01 -0.36 0.00 0.09 0.00 0.00 57.88 57.96 1tvv h LEU 14 Cb 0.20 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1tvv h LEU 14 CO -0.19 0.35 -1.95 0.44 0.09 0.00 0.00 178.44 177.19 1tvv h ASP 15 N 0.59 0.45 0.00 -0.43 5.19 0.10 -3.41 116.42 118.91 1tvv h ASP 15 Ca 0.21 -0.94 0.00 0.00 -0.62 0.00 0.00 57.03 55.68 1tvv h ASP 15 Cb 0.09 -0.15 0.00 0.00 0.18 0.00 0.00 39.33 39.46 1tvv h ASP 15 CO -0.05 1.83 -0.45 -0.62 -3.12 0.00 0.00 179.24 176.83 1tvv n GLU 16 N -3.50 3.96 -1.74 3.56 4.71 0.98 -5.02 120.64 123.60 1tvv n GLU 16 Ca -0.30 -0.00 -0.42 0.00 -0.01 0.00 0.00 57.16 56.42 1tvv n GLU 16 Cb 1.05 -0.92 -0.03 0.00 -1.01 0.00 0.00 31.44 30.53 1tvv n GLU 16 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 1tvv s GLY 17 N -1.87 1.31 0.15 0.62 0.00 0.99 -4.94 107.32 103.58 1tvv s GLY 17 Ca 0.03 1.48 -0.09 0.00 0.00 0.00 0.00 44.72 46.14 1tvv s GLY 17 CO 0.36 3.03 0.46 0.30 0.00 0.00 0.00 173.10 177.25 1tvv s HIS 18 N 2.15 3.51 0.57 1.90 3.76 -0.80 -4.69 115.29 121.69 1tvv s HIS 18 Ca 0.78 0.80 -0.21 0.00 -0.15 0.00 0.00 55.06 56.28 1tvv s HIS 18 Cb -0.47 -2.18 -0.04 0.00 1.11 0.00 0.00 32.58 31.00 1tvv s HIS 18 CO 0.35 0.41 1.30 0.12 -0.85 0.00 0.00 174.74 176.06 1tvv s PHE 19 N -1.60 2.32 -0.30 1.40 2.19 -1.26 -0.89 117.98 119.84 1tvv s PHE 19 Ca 0.40 1.44 -0.14 0.00 0.33 0.00 0.00 56.93 58.96 1tvv s PHE 19 Cb -0.13 -3.68 0.14 0.00 -1.31 0.00 0.00 43.02 38.05 1tvv s PHE 19 CO 0.21 -2.64 0.86 0.21 1.83 0.00 0.00 175.22 175.69 1tvv s LYS 20 N -3.06 0.43 0.96 10.12 2.20 -0.42 -4.81 119.74 125.16 1tvv s LYS 20 Ca 0.74 0.97 -0.14 0.00 -0.36 0.00 0.00 55.97 57.18 1tvv s LYS 20 Cb -0.37 0.48 0.21 0.00 -1.51 0.00 0.00 37.83 36.64 1tvv s LYS 20 CO 0.42 -0.13 1.30 -1.25 -0.36 0.00 0.00 175.35 175.34 1tvv s PRO 21 N 2.31 0.55 0.22 4.03 0.04 -1.26 -0.41 135.00 140.48 1tvv s PRO 21 Ca -0.05 -0.61 -0.08 0.00 0.04 0.00 0.00 61.00 60.29 1tvv s PRO 21 Cb -0.07 -1.90 0.03 0.00 0.04 0.00 0.00 34.50 32.60 1tvv s PRO 21 CO -0.18 -2.43 0.44 -0.40 0.04 0.00 0.00 177.00 174.48 1tvv n ASP 22 N -3.72 -1.29 -0.29 6.66 5.75 -1.24 -4.83 116.55 117.60 1tvv n ASP 22 Ca 0.17 -1.91 0.00 0.00 -0.01 0.00 0.00 54.79 53.04 1tvv n ASP 22 Cb 0.59 2.15 0.07 0.00 -1.03 0.00 0.00 41.12 42.90 1tvv n ASP 22 CO 0.00 0.00 0.00 0.08 -0.11 0.00 0.00 177.20 177.17 1tvv h ARG 23 N 0.00 -0.04 0.00 0.11 0.11 -2.00 0.25 114.38 112.81 1tvv h ARG 23 Ca -0.19 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.89 1tvv h ARG 23 Cb 0.70 0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.79 1tvv h ARG 23 CO 0.24 -0.03 0.00 0.25 0.10 0.00 0.00 179.97 180.53 1tvv n THR 24 N -5.50 0.39 -0.73 0.08 -2.24 -1.26 -4.80 114.28 100.21 1tvv n THR 24 Ca 0.10 0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.97 1tvv n THR 24 Cb 0.40 -0.94 0.00 0.00 -2.10 0.00 0.00 70.33 67.69 1tvv n THR 24 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1tvv n HIS 25 N -1.14 0.00 -3.16 4.78 8.25 0.87 -4.96 115.22 119.86 1tvv n HIS 25 Ca 0.06 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.13 1tvv n HIS 25 Cb 0.06 -1.10 -0.06 0.00 1.12 0.00 0.00 29.99 30.01 1tvv n HIS 25 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1tvv s THR 26 N -1.81 4.71 0.76 1.59 2.01 -1.26 -4.84 115.64 116.80 1tvv s THR 26 Ca 0.00 1.37 -0.11 0.00 0.31 0.00 0.00 61.69 63.26 1tvv s THR 26 Cb 0.00 -3.98 0.05 0.00 0.01 0.00 0.00 72.50 68.58 1tvv s THR 26 CO 0.00 0.49 1.09 -0.83 -0.69 0.00 0.00 174.62 174.67 1tvv s GLY 27 N -0.74 1.64 0.25 4.40 0.00 -1.26 -3.63 107.32 107.98 1tvv s GLY 27 Ca 0.32 -0.13 -0.00 0.00 0.00 0.00 0.00 44.72 44.91 1tvv s GLY 27 CO 0.20 0.26 0.24 -0.51 0.00 0.00 0.00 173.10 173.30 1tvv s THR 28 N -3.14 0.00 -0.19 0.90 -4.23 0.45 -2.30 115.64 107.13 1tvv s THR 28 Ca 0.60 -1.89 0.01 0.00 -1.18 0.00 0.00 61.69 59.23 1tvv s THR 28 Cb -0.14 -2.48 0.03 0.00 1.34 0.00 0.00 72.50 71.25 1tvv s THR 28 CO 0.54 0.00 -0.18 -0.31 -0.54 0.00 0.00 174.62 174.13 1tvv s TYR 29 N -3.84 2.76 0.24 3.99 1.51 -0.56 -1.29 117.35 120.15 1tvv s TYR 29 Ca 0.37 -1.68 0.11 0.00 -1.01 0.00 0.00 57.07 54.85 1tvv s TYR 29 Cb 0.04 -1.87 -0.05 0.00 -0.11 0.00 0.00 41.96 39.97 1tvv s TYR 29 CO 0.17 -0.80 -0.20 -1.12 -1.11 0.00 0.00 175.55 172.49 1tvv s SER 30 N 1.29 3.32 0.09 2.29 0.01 -0.07 -1.16 113.70 119.47 1tvv s SER 30 Ca 0.03 -0.99 0.01 0.00 1.31 0.00 0.00 55.95 56.31 1tvv s SER 30 Cb -0.14 -0.25 -0.04 0.00 0.21 0.00 0.00 66.02 65.80 1tvv s SER 30 CO -0.12 0.01 -0.04 0.27 0.41 0.00 0.00 173.24 173.78 1tvv s ILE 31 N -2.42 0.49 -0.13 1.44 -4.36 -0.24 -1.90 121.20 114.08 1tvv s ILE 31 Ca 0.26 -1.90 -0.00 0.00 -0.26 0.00 0.00 60.65 58.75 1tvv s ILE 31 Cb -0.05 -1.70 0.03 0.00 1.25 0.00 0.00 42.46 41.99 1tvv s ILE 31 CO 0.12 -0.85 -0.08 0.12 0.24 0.00 0.00 174.94 174.49 1tvv s PHE 32 N -3.76 1.64 0.00 1.37 5.36 -1.26 -1.79 117.98 119.54 1tvv s PHE 32 Ca 0.12 -0.88 0.00 0.00 -0.96 0.00 0.00 56.93 55.21 1tvv s PHE 32 Cb 0.06 -1.31 0.00 0.00 -0.34 0.00 0.00 43.02 41.43 1tvv s PHE 32 CO -0.05 -0.56 0.00 0.41 -1.46 0.00 0.00 175.22 173.56 1tvv n GLY 33 N 4.90 -1.72 3.38 13.12 0.00 -0.63 -5.02 105.19 119.23 1tvv n GLY 33 Ca -0.13 -0.64 -0.10 0.00 0.00 0.00 0.00 46.02 45.15 1tvv n GLY 33 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1tvv s HIS 34 N 0.00 0.41 -0.30 1.61 2.46 -1.04 -4.94 115.29 113.49 1tvv s HIS 34 Ca 0.00 -0.76 -0.09 0.00 0.47 0.00 0.00 55.06 54.68 1tvv s HIS 34 Cb 0.00 -0.02 0.15 0.00 -0.13 0.00 0.00 32.58 32.58 1tvv s HIS 34 CO 0.00 -0.77 0.68 -1.14 -2.47 0.00 0.00 174.74 171.04 1tvv s GLN 35 N -3.98 0.54 0.27 2.88 0.74 -1.26 -0.71 119.66 118.15 1tvv s GLN 35 Ca 0.19 1.28 0.07 0.00 0.05 0.00 0.00 55.36 56.95 1tvv s GLN 35 Cb 0.03 0.76 -0.03 0.00 1.10 0.00 0.00 33.01 34.86 1tvv s GLN 35 CO 0.02 -0.27 0.22 -1.64 -0.55 0.00 0.00 175.29 173.07 1tvv s MET 36 N 2.85 2.86 -0.04 1.67 -1.94 -0.19 -4.95 119.30 119.56 1tvv s MET 36 Ca -0.01 -1.12 -0.01 0.00 -1.71 0.00 0.00 55.69 52.83 1tvv s MET 36 Cb -0.12 -2.53 0.03 0.00 2.01 0.00 0.00 34.83 34.22 1tvv s MET 36 CO -0.19 0.32 0.06 0.50 -0.01 0.00 0.00 175.02 175.71 1tvv s ARG 37 N -3.88 -0.04 -0.24 2.03 3.52 -1.26 -1.54 118.95 117.54 1tvv s ARG 37 Ca 0.35 0.32 0.02 0.00 -0.13 0.00 0.00 55.73 56.29 1tvv s ARG 37 Cb -0.07 -0.36 0.06 0.00 -1.56 0.00 0.00 34.95 33.02 1tvv s ARG 37 CO 0.25 -0.25 -0.10 -0.06 -0.81 0.00 0.00 175.30 174.33 1tvv s PHE 38 N 1.66 2.96 -0.38 5.12 0.08 0.53 -4.92 117.98 123.02 1tvv s PHE 38 Ca -0.02 -2.09 -0.28 0.00 0.12 0.00 0.00 56.93 54.66 1tvv s PHE 38 Cb -0.12 -1.82 -0.01 0.00 -0.57 0.00 0.00 43.02 40.50 1tvv s PHE 38 CO -0.03 -0.84 1.67 0.34 -0.10 0.00 0.00 175.22 176.26 1tvv s ASP 39 N 1.21 5.99 0.00 1.36 -1.08 -1.26 -0.75 116.67 122.13 1tvv s ASP 39 Ca -0.07 1.05 0.17 0.00 -0.52 0.00 0.00 52.55 53.18 1tvv s ASP 39 Cb -0.19 -2.53 0.91 0.00 -1.46 0.00 0.00 42.92 39.64 1tvv s ASP 39 CO -0.06 -1.68 1.46 0.18 0.52 0.00 0.00 175.17 175.59 1tvv n LEU 40 N 10.01 0.00 -0.08 -1.34 4.77 0.90 -2.42 117.00 128.83 1tvv n LEU 40 Ca 0.20 0.18 0.12 0.00 -0.03 0.00 0.00 56.01 56.48 1tvv n LEU 40 Cb 0.48 -0.18 0.26 0.00 -2.33 0.00 0.00 43.42 41.65 1tvv n LEU 40 CO 0.69 -0.08 0.48 -1.54 -1.33 0.00 0.00 177.39 175.61 1tvv n SER 41 N -1.18 0.71 0.05 -1.43 3.41 -1.23 -3.62 113.62 110.34 1tvv n SER 41 Ca 0.10 -0.51 0.12 0.00 -0.26 0.00 0.00 58.87 58.31 1tvv n SER 41 Cb 0.10 0.27 0.08 0.00 -0.26 0.00 0.00 64.21 64.40 1tvv n SER 41 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1tvv n LYS 42 N -1.22 0.36 0.00 4.33 4.76 -1.02 -5.05 118.16 120.32 1tvv n LYS 42 Ca 0.07 0.05 0.00 0.00 -2.87 0.00 0.00 58.31 55.57 1tvv n LYS 42 Cb 0.34 -1.67 0.00 0.00 -1.84 0.00 0.00 35.03 31.86 1tvv n LYS 42 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1tvv n GLY 43 N 1.32 0.85 3.63 0.72 0.00 -1.24 -4.89 105.19 105.58 1tvv n GLY 43 Ca 0.02 -1.60 -0.40 0.00 0.00 0.00 0.00 46.02 44.04 1tvv n GLY 43 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1tvv s PHE 44 N -1.61 3.29 -0.75 1.61 5.36 -0.76 -4.59 117.98 120.53 1tvv s PHE 44 Ca 0.00 0.63 -0.09 0.00 -0.96 0.00 0.00 56.93 56.51 1tvv s PHE 44 Cb 0.00 -2.68 -0.08 0.00 -0.34 0.00 0.00 43.02 39.92 1tvv s PHE 44 CO 0.00 -0.22 1.92 -2.30 -1.46 0.00 0.00 175.22 173.16 1tvv n PRO 45 N 5.31 1.65 -3.82 10.12 -0.02 -1.26 -3.92 135.00 143.06 1tvv n PRO 45 Ca -0.05 -1.41 -0.36 0.00 -2.02 0.00 0.00 63.50 59.66 1tvv n PRO 45 Cb 0.50 -2.50 -0.11 0.00 -0.02 0.00 0.00 33.50 31.37 1tvv n PRO 45 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1tvv s LEU 46 N 0.31 3.67 0.09 2.45 2.96 -1.26 -4.20 118.68 122.70 1tvv s LEU 46 Ca 0.39 -0.07 -0.36 0.00 -0.22 0.00 0.00 54.13 53.87 1tvv s LEU 46 Cb 0.10 -1.97 -0.16 0.00 0.50 0.00 0.00 46.19 44.66 1tvv s LEU 46 CO 0.01 0.04 1.38 0.18 -1.32 0.00 0.00 176.35 176.64 1tvv n LEU 47 N 4.45 1.85 -0.01 -0.68 4.77 -1.26 -4.74 117.00 121.39 1tvv n LEU 47 Ca -0.16 1.11 0.10 0.00 -0.03 0.00 0.00 56.01 57.03 1tvv n LEU 47 Cb 0.52 -1.22 -0.14 0.00 -2.33 0.00 0.00 43.42 40.24 1tvv n LEU 47 CO 0.33 -0.93 -0.57 0.35 -1.33 0.00 0.00 177.39 175.23 1tvv n THR 48 N 2.69 0.00 1.87 -5.08 -2.24 -1.26 -4.24 114.28 106.01 1tvv n THR 48 Ca 0.18 -0.36 0.06 0.00 -2.27 0.00 0.00 64.05 61.66 1tvv n THR 48 Cb 0.20 0.27 0.35 0.00 -2.10 0.00 0.00 70.33 69.05 1tvv n THR 48 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1tvv n THR 49 N -2.02 0.00 -3.65 4.28 -2.24 -1.26 -0.59 114.28 108.80 1tvv n THR 49 Ca -0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 1tvv n THR 49 Cb 0.47 -0.23 -0.06 0.00 -2.10 0.00 0.00 70.33 68.41 1tvv n THR 49 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 1tvv s LYS 50 N -2.00 0.07 -0.02 -0.78 -2.85 -1.26 -4.73 119.74 108.16 1tvv s LYS 50 Ca 0.18 0.10 -0.30 0.00 -1.00 0.00 0.00 55.97 54.95 1tvv s LYS 50 Cb 0.08 0.02 -0.07 0.00 -2.06 0.00 0.00 37.83 35.80 1tvv s LYS 50 CO 0.14 -0.01 1.89 0.21 0.10 0.00 0.00 175.35 177.68 1tvv s LYS 51 N 0.71 4.04 -0.09 1.78 2.20 -0.99 -4.64 119.74 122.75 1tvv s LYS 51 Ca -0.03 2.40 0.00 0.00 -0.36 0.00 0.00 55.97 57.98 1tvv s LYS 51 Cb -0.03 -4.13 -0.03 0.00 -1.51 0.00 0.00 37.83 32.13 1tvv s LYS 51 CO -0.12 -1.05 -0.09 0.08 -0.36 0.00 0.00 175.35 173.81 1tvv s VAL 52 N 4.75 3.50 -0.93 4.02 1.01 -1.26 -4.74 120.40 126.75 1tvv s VAL 52 Ca 0.85 -0.53 -0.24 0.00 0.00 0.00 0.00 61.98 62.06 1tvv s VAL 52 Cb -0.38 -2.45 0.05 0.00 0.00 0.00 0.00 36.38 33.59 1tvv s VAL 52 CO 0.37 0.56 1.37 -2.16 0.00 0.00 0.00 175.10 175.25 1tvv s PRO 53 N -0.33 3.48 0.59 2.72 0.04 -1.26 -4.85 135.00 135.39 1tvv s PRO 53 Ca 0.04 -0.94 0.30 0.00 0.04 0.00 0.00 61.00 60.44 1tvv s PRO 53 Cb -0.13 -5.01 1.74 0.00 0.04 0.00 0.00 34.50 31.15 1tvv s PRO 53 CO 0.02 -2.15 2.16 0.35 0.04 0.00 0.00 177.00 177.42 1tvv h PHE 54 N 9.79 0.00 -0.01 0.56 3.57 -1.99 -2.03 116.94 126.83 1tvv h PHE 54 Ca 0.06 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.56 1tvv h PHE 54 Cb 1.02 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.76 1tvv h PHE 54 CO 1.23 0.00 0.01 0.78 -2.23 0.00 0.00 178.31 178.09 1tvv h GLY 55 N 0.00 0.02 1.01 2.40 0.00 -2.00 -1.13 103.07 103.37 1tvv h GLY 55 Ca 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.38 1tvv h GLY 55 CO -0.00 0.01 0.60 1.41 0.00 0.00 0.00 176.54 178.56 1tvv h LEU 56 N -0.09 1.11 -0.61 3.11 3.38 -1.75 -1.56 115.31 118.91 1tvv h LEU 56 Ca 0.00 -0.05 0.02 0.00 0.09 0.00 0.00 57.88 57.95 1tvv h LEU 56 Cb 0.10 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.53 1tvv h LEU 56 CO -0.00 0.83 0.38 0.40 0.09 0.00 0.00 178.44 180.14 1tvv h ILE 57 N 1.30 1.08 0.25 1.22 2.04 -1.36 -1.19 117.51 120.86 1tvv h ILE 57 Ca 0.34 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.93 1tvv h ILE 57 Cb -0.10 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 36.25 1tvv h ILE 57 CO -0.07 0.14 -0.12 0.11 0.00 0.00 0.00 178.15 178.21 1tvv h LYS 58 N 0.75 -0.33 -0.43 2.37 1.57 -0.84 -2.29 116.57 117.36 1tvv h LYS 58 Ca 0.24 0.02 0.09 0.00 -1.87 0.00 0.00 60.65 59.13 1tvv h LYS 58 Cb 0.01 0.07 -0.09 0.00 0.08 0.00 0.00 32.23 32.30 1tvv h LYS 58 CO -0.09 -0.05 -0.29 0.77 -0.57 0.00 0.00 179.45 179.22 1tvv h SER 59 N -0.59 -0.96 -0.44 0.86 0.02 -1.12 -1.03 113.55 110.29 1tvv h SER 59 Ca -0.03 0.19 -0.01 0.00 -0.84 0.00 0.00 61.79 61.09 1tvv h SER 59 Cb 0.43 0.47 -0.02 0.00 0.14 0.00 0.00 62.40 63.42 1tvv h SER 59 CO 0.06 -0.29 0.24 -0.08 -1.14 0.00 0.00 176.83 175.61 1tvv h GLU 60 N -0.20 0.62 -0.73 3.45 4.81 -1.25 -2.27 114.58 119.01 1tvv h GLU 60 Ca 0.19 -0.08 -0.05 0.00 -0.13 0.00 0.00 59.36 59.29 1tvv h GLU 60 Cb 0.51 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.74 1tvv h GLU 60 CO -0.54 0.51 0.25 1.25 -0.73 0.00 0.00 179.01 179.75 1tvv h LEU 61 N 0.58 1.04 -0.94 1.64 5.85 -0.81 -2.30 115.31 120.37 1tvv h LEU 61 Ca 0.15 -0.19 -0.08 0.00 0.84 0.00 0.00 57.88 58.60 1tvv h LEU 61 Cb 0.07 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.81 1tvv h LEU 61 CO -0.02 0.96 -0.13 -0.07 -0.34 0.00 0.00 178.44 178.83 1tvv h LEU 62 N 1.07 0.62 -0.41 2.25 4.07 -1.09 -0.74 115.31 121.07 1tvv h LEU 62 Ca 0.24 -0.18 0.03 0.00 0.08 0.00 0.00 57.88 58.06 1tvv h LEU 62 Cb 0.27 -0.17 -0.04 0.00 1.08 0.00 0.00 40.66 41.81 1tvv h LEU 62 CO -0.01 0.77 0.20 -0.25 -1.08 0.00 0.00 178.44 178.07 1tvv h TRP 63 N 0.57 0.37 -0.12 1.13 7.01 -1.02 -1.51 115.95 122.38 1tvv h TRP 63 Ca 0.10 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.11 1tvv h TRP 63 Cb 0.56 -0.11 -0.01 0.00 -2.10 0.00 0.00 29.16 27.50 1tvv h TRP 63 CO 0.02 0.19 0.05 0.74 -2.79 0.00 0.00 178.44 176.65 1tvv h PHE 64 N 0.41 0.18 0.00 2.65 0.04 -0.99 -2.56 116.94 116.67 1tvv h PHE 64 Ca 0.18 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.94 1tvv h PHE 64 Cb 0.09 -0.05 0.00 0.00 2.20 0.00 0.00 35.95 38.18 1tvv h PHE 64 CO -0.10 0.26 0.00 -0.07 -0.60 0.00 0.00 178.31 177.80 1tvv h LEU 65 N 0.04 0.00 -1.08 1.54 4.07 -0.76 -1.05 115.31 118.07 1tvv h LEU 65 Ca 0.04 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.00 1tvv h LEU 65 Cb 0.16 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.90 1tvv h LEU 65 CO -0.00 0.00 -0.09 1.41 -1.08 0.00 0.00 178.44 178.67 1tvv n HIS 66 N -2.83 0.00 -1.16 1.13 8.25 -0.60 -4.79 115.22 115.21 1tvv n HIS 66 Ca -0.02 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.38 1tvv n HIS 66 Cb 0.09 -0.02 -0.02 0.00 1.12 0.00 0.00 29.99 31.15 1tvv n HIS 66 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1tvv n GLY 67 N 1.27 0.74 3.83 -1.41 0.00 -0.40 -4.98 105.19 104.24 1tvv n GLY 67 Ca 0.16 -0.28 -0.33 0.00 0.00 0.00 0.00 46.02 45.57 1tvv n GLY 67 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1tvv s ASP 68 N -2.46 6.80 0.00 1.61 -1.08 -1.06 -4.26 116.67 116.23 1tvv s ASP 68 Ca 0.00 1.65 0.00 0.00 -0.52 0.00 0.00 52.55 53.68 1tvv s ASP 68 Cb 0.00 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 38.93 1tvv s ASP 68 CO 0.00 -0.46 0.45 0.35 0.52 0.00 0.00 175.17 176.03 1tvv n THR 69 N -1.03 0.06 -4.05 1.71 -2.24 -1.26 -4.22 114.28 103.25 1tvv n THR 69 Ca 0.07 -0.07 -0.36 0.00 -2.27 0.00 0.00 64.05 61.42 1tvv n THR 69 Cb 0.54 1.13 -0.07 0.00 -2.10 0.00 0.00 70.33 69.82 1tvv n THR 69 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1tvv s ASN 70 N -0.06 5.98 0.48 3.42 3.84 -1.26 -0.79 114.94 126.54 1tvv s ASN 70 Ca 0.00 0.34 0.19 0.00 0.21 0.00 0.00 52.86 53.59 1tvv s ASN 70 Cb 0.00 -1.85 1.18 0.00 -0.55 0.00 0.00 41.25 40.03 1tvv s ASN 70 CO 0.00 0.38 2.04 0.40 -2.79 0.00 0.00 177.10 177.13 1tvv h ILE 71 N 3.91 0.95 -0.86 -5.21 1.08 -0.96 -3.29 117.51 113.13 1tvv h ILE 71 Ca -0.53 -0.53 0.22 0.00 -0.39 0.00 0.00 64.86 63.62 1tvv h ILE 71 Cb 1.21 1.30 -0.15 0.00 -3.07 0.00 0.00 36.82 36.11 1tvv h ILE 71 CO 0.58 0.14 0.06 -0.09 -0.69 0.00 0.00 178.15 178.15 1tvv h ARG 72 N 0.00 0.09 0.02 2.37 2.43 -1.92 0.16 114.38 117.53 1tvv h ARG 72 Ca -0.00 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1tvv h ARG 72 Cb 0.29 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.82 1tvv h ARG 72 CO 0.02 0.06 -0.01 0.35 -1.51 0.00 0.00 179.97 178.88 1tvv h PHE 73 N 0.10 -0.03 -0.77 2.20 3.04 -1.99 -1.44 116.94 118.05 1tvv h PHE 73 Ca 0.50 -0.00 -0.00 0.00 3.98 0.00 0.00 57.97 62.45 1tvv h PHE 73 Cb 0.97 0.01 -0.04 0.00 2.56 0.00 0.00 35.95 39.45 1tvv h PHE 73 CO -0.42 0.04 0.47 -0.07 -2.02 0.00 0.00 178.31 176.31 1tvv h LEU 74 N -0.09 0.92 -0.48 0.59 3.38 -1.30 -2.70 115.31 115.64 1tvv h LEU 74 Ca -0.00 -0.06 0.03 0.00 0.09 0.00 0.00 57.88 57.93 1tvv h LEU 74 Cb 0.08 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 1tvv h LEU 74 CO 0.00 0.71 0.28 -0.07 0.09 0.00 0.00 178.44 179.45 1tvv h LEU 75 N 1.05 0.43 -2.74 1.67 3.38 -0.45 0.11 115.31 118.77 1tvv h LEU 75 Ca 0.28 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.26 1tvv h LEU 75 Cb -0.04 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1tvv h LEU 75 CO -0.05 0.31 0.02 1.56 0.09 0.00 0.00 178.44 180.36 1tvv h GLN 76 N 0.55 0.00 -0.62 1.13 4.20 -0.95 0.15 115.11 119.57 1tvv h GLN 76 Ca 0.20 0.00 -0.21 0.00 0.06 0.00 0.00 58.65 58.70 1tvv h GLN 76 Cb 0.05 0.00 -0.13 0.00 0.30 0.00 0.00 27.48 27.70 1tvv h GLN 76 CO -0.10 0.00 0.21 0.72 -0.67 0.00 0.00 178.83 178.98 1tvv n HIS 77 N -2.96 2.01 -1.68 2.96 8.25 0.22 -4.91 115.22 119.11 1tvv n HIS 77 Ca -0.03 -1.31 -0.15 0.00 -0.26 0.00 0.00 57.72 55.97 1tvv n HIS 77 Cb 0.08 -0.62 -0.05 0.00 1.12 0.00 0.00 29.99 30.52 1tvv n HIS 77 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1tvv n ARG 78 N -0.53 -1.51 -3.44 -0.41 1.74 0.54 -4.93 116.66 108.12 1tvv n ARG 78 Ca 0.39 0.85 -0.38 0.00 -0.77 0.00 0.00 57.85 57.93 1tvv n ARG 78 Cb 1.27 -5.21 -0.08 0.00 -1.02 0.00 0.00 32.46 27.43 1tvv n ARG 78 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1tvv s ASN 79 N -2.21 6.39 0.00 0.55 3.84 -0.19 -4.93 114.94 118.38 1tvv s ASN 79 Ca 0.00 0.46 0.00 0.00 0.21 0.00 0.00 52.86 53.53 1tvv s ASN 79 Cb 0.00 -2.21 0.00 0.00 -0.55 0.00 0.00 41.25 38.49 1tvv s ASN 79 CO 0.00 -0.04 0.95 1.41 -2.79 0.00 0.00 177.10 176.63 1tvv n HIS 80 N 4.36 0.00 -0.27 0.43 8.25 -1.26 -3.60 115.22 123.12 1tvv n HIS 80 Ca -0.10 -0.45 0.23 0.00 -0.26 0.00 0.00 57.72 57.14 1tvv n HIS 80 Cb 0.51 -0.05 0.56 0.00 1.12 0.00 0.00 29.99 32.14 1tvv n HIS 80 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 1tvv h ILE 81 N 0.20 0.58 -0.40 1.59 2.04 -1.97 -1.69 117.51 117.87 1tvv h ILE 81 Ca 0.00 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.76 1tvv h ILE 81 Cb 0.52 0.25 0.00 0.00 -0.74 0.00 0.00 36.82 36.85 1tvv h ILE 81 CO 0.00 0.06 0.00 0.79 0.00 0.00 0.00 178.15 179.00 1tvv n TRP 82 N -4.48 1.41 -0.03 1.37 7.02 -1.26 -4.69 117.44 116.77 1tvv n TRP 82 Ca 0.22 -0.81 -0.12 0.00 -1.02 0.00 0.00 57.50 55.77 1tvv n TRP 82 Cb 0.85 -0.39 -0.07 0.00 -2.42 0.00 0.00 31.31 29.28 1tvv n TRP 82 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 1tvv h ASP 83 N 2.74 0.19 -0.91 -0.99 5.19 -1.66 -3.22 116.42 117.76 1tvv h ASP 83 Ca 0.00 -0.38 0.19 0.00 -0.62 0.00 0.00 57.03 56.23 1tvv h ASP 83 Cb 1.65 -0.05 -0.07 0.00 0.18 0.00 0.00 39.33 41.04 1tvv h ASP 83 CO 0.33 0.52 0.60 -0.33 -3.12 0.00 0.00 179.24 177.24 1tvv h GLU 84 N -0.15 0.48 -0.64 3.56 5.08 -1.83 0.36 114.58 121.44 1tvv h GLU 84 Ca 0.02 -0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.26 1tvv h GLU 84 Cb 0.44 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 1tvv h GLU 84 CO 0.01 0.32 0.04 -1.49 -1.00 0.00 0.00 179.01 176.89 1tvv h TRP 85 N 0.50 1.18 -0.00 4.33 4.06 -1.91 0.19 115.95 124.29 1tvv h TRP 85 Ca 0.48 -0.19 -0.01 0.00 2.06 0.00 0.00 58.89 61.24 1tvv h TRP 85 Cb 1.07 -0.31 0.00 0.00 -1.00 0.00 0.00 29.16 28.91 1tvv h TRP 85 CO -0.00 1.02 -0.02 0.00 -3.56 0.00 0.00 178.44 175.88 1tvv h ALA 86 N 1.01 0.01 -0.63 1.49 0.00 -1.28 -3.14 119.26 116.72 1tvv h ALA 86 Ca 0.19 -0.34 0.10 0.00 0.00 0.00 0.00 54.91 54.85 1tvv h ALA 86 Cb 0.52 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.23 1tvv h ALA 86 CO 0.02 -0.14 0.24 0.35 0.00 0.00 0.00 179.25 179.73 1tvv h PHE 87 N -0.64 0.42 -0.42 0.00 3.57 -0.94 -0.54 116.94 118.39 1tvv h PHE 87 Ca -0.00 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.56 1tvv h PHE 87 Cb 0.69 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.32 1tvv h PHE 87 CO 0.16 0.10 0.28 1.49 -2.23 0.00 0.00 178.31 178.11 1tvv h GLU 88 N 0.42 0.42 0.02 1.11 4.81 -0.68 -0.58 114.58 120.10 1tvv h GLU 88 Ca 0.32 -0.03 -0.20 0.00 -0.13 0.00 0.00 59.36 59.32 1tvv h GLU 88 Cb 0.40 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.67 1tvv h GLU 88 CO -0.31 0.28 -0.94 -0.22 -0.73 0.00 0.00 179.01 177.09 1tvv h LYS 89 N 0.43 0.09 -0.31 1.92 3.64 -1.08 -2.88 116.57 118.39 1tvv h LYS 89 Ca 0.17 -0.12 -0.09 0.00 -1.27 0.00 0.00 60.65 59.33 1tvv h LYS 89 Cb 0.14 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.99 1tvv h LYS 89 CO -0.04 0.96 -0.17 2.35 -2.27 0.00 0.00 179.45 180.28 1tvv h TRP 90 N 0.04 0.78 -0.11 1.91 -0.00 -0.47 -2.98 115.95 115.12 1tvv h TRP 90 Ca -0.03 -0.20 -0.11 0.00 -0.00 0.00 0.00 58.89 58.54 1tvv h TRP 90 Cb 1.61 -0.18 -0.01 0.00 -0.00 0.00 0.00 29.16 30.59 1tvv h TRP 90 CO 0.02 0.90 -0.44 0.28 -0.00 0.00 0.00 178.44 179.20 1tvv h VAL 91 N 0.43 1.32 -0.11 2.65 2.07 -1.19 -2.94 116.25 118.48 1tvv h VAL 91 Ca 0.07 -1.58 0.00 0.00 0.82 0.00 0.00 66.70 66.01 1tvv h VAL 91 Cb 0.71 1.72 0.00 0.00 -1.52 0.00 0.00 31.29 32.20 1tvv h VAL 91 CO 0.05 0.47 0.00 2.29 0.02 0.00 0.00 177.57 180.40 1tvv n LYS 92 N -4.01 1.55 -3.64 1.57 -0.00 -1.09 -4.91 118.16 107.63 1tvv n LYS 92 Ca -0.02 -0.82 -0.23 0.00 -0.00 0.00 0.00 58.31 57.24 1tvv n LYS 92 Cb 0.50 -1.39 -0.01 0.00 -0.00 0.00 0.00 35.03 34.13 1tvv n LYS 92 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 1tvv s SER 93 N -1.64 4.86 1.24 -5.58 1.04 -1.11 -5.08 113.70 107.44 1tvv s SER 93 Ca 0.33 -0.98 -0.18 0.00 0.48 0.00 0.00 55.95 55.60 1tvv s SER 93 Cb 0.17 -0.04 0.30 0.00 0.10 0.00 0.00 66.02 66.55 1tvv s SER 93 CO 0.27 -0.93 1.02 -1.81 0.98 0.00 0.00 173.24 172.77 1tvv s ASP 94 N -4.26 0.45 0.00 7.02 1.11 -1.26 -3.79 116.67 115.93 1tvv s ASP 94 Ca 0.44 1.01 0.00 0.00 0.18 0.00 0.00 52.55 54.18 1tvv s ASP 94 Cb -0.03 -1.51 0.00 0.00 1.07 0.00 0.00 42.92 42.45 1tvv s ASP 94 CO 0.26 -4.46 0.00 1.21 1.18 0.00 0.00 175.17 173.37 1tvv n GLU 95 N -5.04 0.00 -1.56 8.23 4.07 -1.26 -4.91 120.64 120.18 1tvv n GLU 95 Ca 0.09 0.00 -0.38 0.00 -0.06 0.00 0.00 57.16 56.80 1tvv n GLU 95 Cb 0.58 -1.14 -0.03 0.00 -0.06 0.00 0.00 31.44 30.79 1tvv n GLU 95 CO 0.00 0.00 0.00 0.98 -0.06 0.00 0.00 177.13 178.05 1tvv n TYR 96 N 0.00 1.55 -3.82 4.31 9.36 -1.25 -4.88 117.16 122.42 1tvv n TYR 96 Ca 0.00 0.07 -0.35 0.00 3.32 0.00 0.00 57.90 60.94 1tvv n TYR 96 Cb 0.00 -2.65 -0.12 0.00 -0.63 0.00 0.00 39.34 35.94 1tvv n TYR 96 CO 0.00 0.00 0.00 -1.01 0.22 0.00 0.00 176.86 176.07 1tvv s HIS 97 N 11.01 3.59 0.00 2.98 3.76 -1.26 -5.03 115.29 130.34 1tvv s HIS 97 Ca 1.00 -2.59 0.00 0.00 -0.15 0.00 0.00 55.06 53.32 1tvv s HIS 97 Cb -0.27 -3.15 0.00 0.00 1.11 0.00 0.00 32.58 30.27 1tvv s HIS 97 CO 0.30 -0.95 0.00 0.41 -0.85 0.00 0.00 174.74 173.65 1tvv n GLY 98 N 4.35 -0.79 3.58 -2.22 0.00 -1.26 -5.13 105.19 103.71 1tvv n GLY 98 Ca 0.00 -0.98 -0.54 0.00 0.00 0.00 0.00 46.02 44.51 1tvv n GLY 98 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1tvv n PRO 99 N -0.01 0.90 -1.63 1.61 -0.02 -1.26 -4.80 135.00 129.80 1tvv n PRO 99 Ca 0.00 0.33 -0.47 0.00 -2.02 0.00 0.00 63.50 61.33 1tvv n PRO 99 Cb 0.00 -1.94 -0.05 0.00 -0.02 0.00 0.00 33.50 31.49 1tvv n PRO 99 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1tvv n ASP 100 N 2.39 3.26 -1.20 2.55 2.03 -1.26 -4.85 116.55 119.47 1tvv n ASP 100 Ca 0.19 0.74 0.09 0.00 0.52 0.00 0.00 54.79 56.33 1tvv n ASP 100 Cb 0.16 -1.40 0.28 0.00 -0.72 0.00 0.00 41.12 39.44 1tvv n ASP 100 CO 0.00 0.00 0.00 0.23 -1.92 0.00 0.00 177.20 175.51 1tvv n MET 101 N 7.36 2.70 -1.45 -0.67 2.81 -1.26 -4.97 117.12 121.65 1tvv n MET 101 Ca 0.27 -2.23 -0.53 0.00 -1.81 0.00 0.00 57.70 53.40 1tvv n MET 101 Cb 0.32 -1.58 -0.08 0.00 -0.71 0.00 0.00 33.22 31.17 1tvv n MET 101 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 1tvv n THR 102 N 1.13 0.18 -2.56 2.03 -1.04 -1.26 -0.72 114.28 112.04 1tvv n THR 102 Ca 0.20 -0.20 -0.02 0.00 -2.04 0.00 0.00 64.05 61.99 1tvv n THR 102 Cb 0.60 -1.45 0.01 0.00 -1.82 0.00 0.00 70.33 67.66 1tvv n THR 102 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 1tvv n ASP 103 N 9.04 -2.34 -0.14 8.00 2.03 -1.26 -4.97 116.55 126.91 1tvv n ASP 103 Ca 0.41 -0.05 -0.08 0.00 0.52 0.00 0.00 54.79 55.60 1tvv n ASP 103 Cb 0.18 -0.93 0.00 0.00 -0.72 0.00 0.00 41.12 39.66 1tvv n ASP 103 CO 0.00 0.00 0.00 2.19 -1.92 0.00 0.00 177.20 177.47 1tvv h PHE 104 N -0.24 0.55 -0.30 -0.67 -0.00 -1.31 -1.33 116.94 113.63 1tvv h PHE 104 Ca -0.05 0.01 0.03 0.00 -0.00 0.00 0.00 57.97 57.96 1tvv h PHE 104 Cb 1.04 -0.18 -0.03 0.00 -0.00 0.00 0.00 35.95 36.77 1tvv h PHE 104 CO 0.05 0.36 0.09 0.78 -0.00 0.00 0.00 178.31 179.59 1tvv h GLY 105 N 0.57 0.36 0.46 6.09 0.00 -1.94 -0.18 103.07 108.43 1tvv h GLY 105 Ca 0.15 -0.05 -0.00 0.00 0.00 0.00 0.00 47.33 47.43 1tvv h GLY 105 CO -0.03 0.02 -0.02 0.84 0.00 0.00 0.00 176.54 177.35 1tvv h HIS 106 N 0.22 -0.06 -0.50 5.60 -0.00 -1.95 -3.31 115.15 115.14 1tvv h HIS 106 Ca 0.13 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.51 1tvv h HIS 106 Cb 0.11 0.02 -0.02 0.00 -0.00 0.00 0.00 27.41 27.52 1tvv h HIS 106 CO -0.14 0.45 0.33 0.00 -0.00 0.00 0.00 177.93 178.57 1tvv h ARG 107 N -0.61 0.67 -0.97 5.26 3.08 -1.18 -3.02 114.38 117.62 1tvv h ARG 107 Ca -0.01 -0.04 0.31 0.00 0.07 0.00 0.00 59.98 60.31 1tvv h ARG 107 Cb 0.53 -0.15 -0.15 0.00 0.08 0.00 0.00 29.97 30.28 1tvv h ARG 107 CO 0.01 0.45 0.42 0.77 -1.07 0.00 0.00 179.97 180.55 1tvv h SER 108 N 0.69 0.25 0.35 7.04 0.02 -1.11 0.50 113.55 121.30 1tvv h SER 108 Ca 0.18 0.21 -0.09 0.00 -0.84 0.00 0.00 61.79 61.25 1tvv h SER 108 Cb -0.07 0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.68 1tvv h SER 108 CO -0.04 -0.21 -0.41 1.56 -1.14 0.00 0.00 176.83 176.59 1tvv h GLN 109 N 0.21 0.08 0.00 3.45 4.20 -1.72 -3.38 115.11 117.96 1tvv h GLN 109 Ca 0.69 -0.04 -0.08 0.00 0.06 0.00 0.00 58.65 59.29 1tvv h GLN 109 Cb 1.57 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.34 1tvv h GLN 109 CO -0.67 0.48 -0.86 1.63 -0.67 0.00 0.00 178.83 178.73 1tvv n LYS 110 N -4.04 0.49 -2.93 1.46 4.76 0.16 -4.86 118.16 113.20 1tvv n LYS 110 Ca -0.02 0.48 -0.43 0.00 -2.87 0.00 0.00 58.31 55.47 1tvv n LYS 110 Cb 0.45 -1.65 -0.05 0.00 -1.84 0.00 0.00 35.03 31.94 1tvv n LYS 110 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1tvv s ASP 111 N -6.10 6.35 0.10 4.39 1.11 -0.16 -4.96 116.67 117.40 1tvv s ASP 111 Ca -0.21 -0.36 -0.31 0.00 0.18 0.00 0.00 52.55 51.85 1tvv s ASP 111 Cb 0.04 -2.39 -0.12 0.00 1.07 0.00 0.00 42.92 41.52 1tvv s ASP 111 CO 0.34 -1.06 1.60 -0.65 1.18 0.00 0.00 175.17 176.58 1tvv h PRO 112 N 9.14 -0.69 -0.20 8.23 0.11 -1.87 -1.37 132.00 145.36 1tvv h PRO 112 Ca -0.26 0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.87 1tvv h PRO 112 Cb 1.08 0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 1tvv h PRO 112 CO 1.02 -0.46 -0.01 1.05 -0.21 0.00 0.00 178.00 179.40 1tvv h GLU 113 N -0.71 0.28 -0.36 1.05 -0.00 -1.96 -2.10 114.58 110.78 1tvv h GLU 113 Ca -0.00 -0.04 -0.01 0.00 -0.00 0.00 0.00 59.36 59.31 1tvv h GLU 113 Cb 0.69 -0.05 -0.02 0.00 -0.00 0.00 0.00 28.75 29.37 1tvv h GLU 113 CO -0.15 0.32 0.20 0.35 -0.00 0.00 0.00 179.01 179.73 1tvv h PHE 114 N 0.28 0.49 -0.82 2.06 3.57 -1.83 -1.14 116.94 119.55 1tvv h PHE 114 Ca 0.07 -0.01 0.15 0.00 3.53 0.00 0.00 57.97 61.71 1tvv h PHE 114 Cb 0.20 -0.16 -0.06 0.00 2.79 0.00 0.00 35.95 38.73 1tvv h PHE 114 CO 0.00 0.38 0.54 0.00 -2.23 0.00 0.00 178.31 177.00 1tvv h ALA 115 N 1.07 2.02 0.07 2.41 0.00 -0.56 0.51 119.26 124.77 1tvv h ALA 115 Ca 0.13 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 1tvv h ALA 115 Cb 0.04 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1tvv h ALA 115 CO -0.02 -0.24 -0.03 0.00 0.00 0.00 0.00 179.25 178.95 1tvv h ALA 116 N 1.62 -0.10 0.19 0.00 0.00 -1.03 -0.60 119.26 119.35 1tvv h ALA 116 Ca 0.41 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 1tvv h ALA 116 Cb 0.83 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1tvv h ALA 116 CO -0.16 -0.40 -0.15 0.28 0.00 0.00 0.00 179.25 178.82 1tvv h VAL 117 N -0.41 0.67 -0.45 0.00 2.07 -0.47 -2.72 116.25 114.93 1tvv h VAL 117 Ca -0.01 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.55 1tvv h VAL 117 Cb 0.35 0.67 -0.04 0.00 -1.52 0.00 0.00 31.29 30.75 1tvv h VAL 117 CO 0.02 0.00 0.22 0.22 0.02 0.00 0.00 177.57 178.05 1tvv h TYR 118 N -0.36 0.40 -0.81 1.57 3.20 -0.99 -1.24 116.97 118.74 1tvv h TYR 118 Ca -0.01 0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.93 1tvv h TYR 118 Cb 0.32 -0.12 -0.05 0.00 1.54 0.00 0.00 36.73 38.43 1tvv h TYR 118 CO -0.11 0.20 0.53 0.45 -1.64 0.00 0.00 178.16 177.59 1tvv h HIS 119 N 0.44 0.94 0.08 -3.82 3.86 -0.94 0.75 115.15 116.46 1tvv h HIS 119 Ca 0.19 0.02 -0.25 0.00 -1.16 0.00 0.00 60.37 59.18 1tvv h HIS 119 Cb 0.11 -0.31 0.00 0.00 1.06 0.00 0.00 27.41 28.27 1tvv h HIS 119 CO -0.11 0.52 -1.12 0.93 0.86 0.00 0.00 177.93 179.01 1tvv h GLU 120 N 0.95 0.28 -0.83 2.45 4.39 -1.21 -1.78 114.58 118.83 1tvv h GLU 120 Ca 0.34 -0.40 0.02 0.00 0.34 0.00 0.00 59.36 59.66 1tvv h GLU 120 Cb 0.13 0.14 -0.05 0.00 -0.10 0.00 0.00 28.75 28.87 1tvv h GLU 120 CO -0.11 1.15 0.54 0.93 -1.16 0.00 0.00 179.01 180.36 1tvv h GLU 121 N 0.11 1.03 0.15 2.33 4.39 -0.53 0.46 114.58 122.53 1tvv h GLU 121 Ca -0.10 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.53 1tvv h GLU 121 Cb 1.82 -0.23 0.00 0.00 -0.10 0.00 0.00 28.75 30.24 1tvv h GLU 121 CO 0.18 0.68 -0.07 1.98 -1.16 0.00 0.00 179.01 180.62 1tvv h MET 122 N 1.07 -0.20 -0.94 2.33 4.05 -0.86 -1.50 114.93 118.87 1tvv h MET 122 Ca 0.32 0.01 0.19 0.00 -0.28 0.00 0.00 59.70 59.95 1tvv h MET 122 Cb -0.05 0.05 -0.08 0.00 -0.80 0.00 0.00 31.60 30.72 1tvv h MET 122 CO -0.09 -0.05 0.61 0.00 0.23 0.00 0.00 176.91 177.60 1tvv h ALA 123 N 0.52 2.01 0.16 0.39 0.00 -0.48 -0.72 119.26 121.13 1tvv h ALA 123 Ca -0.02 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1tvv h ALA 123 Cb 0.24 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1tvv h ALA 123 CO 0.03 -0.32 -0.08 0.87 0.00 0.00 0.00 179.25 179.76 1tvv h LYS 124 N 0.55 -0.21 -0.69 0.00 1.79 -0.58 -2.97 116.57 114.47 1tvv h LYS 124 Ca 0.51 0.01 0.14 0.00 -2.18 0.00 0.00 60.65 59.13 1tvv h LYS 124 Cb 1.05 0.05 -0.10 0.00 -1.58 0.00 0.00 32.23 31.65 1tvv h LYS 124 CO -0.24 0.23 0.17 0.35 -1.08 0.00 0.00 179.45 178.87 1tvv h PHE 125 N -0.82 0.26 -0.71 -1.35 3.57 -0.44 0.59 116.94 118.04 1tvv h PHE 125 Ca -0.02 0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.52 1tvv h PHE 125 Cb 0.53 -0.01 -0.03 0.00 2.79 0.00 0.00 35.95 39.23 1tvv h PHE 125 CO 0.08 -0.06 0.43 -0.44 -2.23 0.00 0.00 178.31 176.10 1tvv h ASP 126 N 0.28 0.84 -0.37 0.41 3.32 -1.24 -0.41 116.42 119.25 1tvv h ASP 126 Ca 0.38 -0.04 -0.08 0.00 0.02 0.00 0.00 57.03 57.31 1tvv h ASP 126 Cb 0.61 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 1tvv h ASP 126 CO -0.47 0.64 -0.08 -0.78 -1.72 0.00 0.00 179.24 176.83 1tvv h ASP 127 N 0.97 0.71 -0.46 6.45 3.58 -0.78 0.11 116.42 127.01 1tvv h ASP 127 Ca 0.26 -0.36 -0.00 0.00 0.42 0.00 0.00 57.03 57.34 1tvv h ASP 127 Cb -0.05 -0.19 -0.02 0.00 1.72 0.00 0.00 39.33 40.78 1tvv h ASP 127 CO -0.05 0.90 0.28 0.03 -2.88 0.00 0.00 179.24 177.52 1tvv h ARG 128 N 0.51 0.62 0.56 0.28 2.47 -0.56 0.27 114.38 118.53 1tvv h ARG 128 Ca 0.09 -0.06 -0.02 0.00 -1.26 0.00 0.00 59.98 58.74 1tvv h ARG 128 Cb 0.59 -0.13 -0.01 0.00 -1.65 0.00 0.00 29.97 28.77 1tvv h ARG 128 CO 0.04 0.46 -0.38 0.28 0.56 0.00 0.00 179.97 180.92 1tvv h VAL 129 N 0.61 0.22 -0.49 2.04 2.07 -0.91 0.47 116.25 120.25 1tvv h VAL 129 Ca 0.16 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.83 1tvv h VAL 129 Cb -0.00 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 29.97 1tvv h VAL 129 CO -0.03 0.00 0.39 0.25 0.02 0.00 0.00 177.57 178.20 1tvv h LEU 130 N -0.91 0.00 0.00 2.57 5.85 -0.69 -3.32 115.31 118.82 1tvv h LEU 130 Ca -0.06 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.56 1tvv h LEU 130 Cb 0.75 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.77 1tvv h LEU 130 CO 0.04 0.00 -1.35 1.41 -0.34 0.00 0.00 178.44 178.20 1tvv n HIS 131 N -4.17 0.00 -2.74 1.25 8.25 0.06 -4.90 115.22 112.96 1tvv n HIS 131 Ca 0.09 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.13 1tvv n HIS 131 Cb 0.60 -0.23 -0.03 0.00 1.12 0.00 0.00 29.99 31.45 1tvv n HIS 131 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1tvv s ASP 132 N -4.62 6.33 0.55 0.41 2.15 0.16 -4.86 116.67 116.78 1tvv s ASP 132 Ca -0.08 -1.17 0.32 0.00 0.43 0.00 0.00 52.55 52.04 1tvv s ASP 132 Cb 0.02 -2.48 1.48 0.00 -0.30 0.00 0.00 42.92 41.65 1tvv s ASP 132 CO 0.14 -1.47 1.87 -0.78 -0.17 0.00 0.00 175.17 174.76 1tvv h ASP 133 N 9.57 0.00 -0.12 -0.34 1.82 -1.82 0.23 116.42 125.76 1tvv h ASP 133 Ca -0.10 0.00 -0.12 0.00 -0.39 0.00 0.00 57.03 56.42 1tvv h ASP 133 Cb 1.04 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.06 1tvv h ASP 133 CO 1.24 0.00 -0.39 0.00 -1.61 0.00 0.00 179.24 178.48 1tvv h ALA 134 N 1.50 0.20 0.18 -0.78 0.00 -1.93 -2.02 119.26 116.42 1tvv h ALA 134 Ca 0.42 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1tvv h ALA 134 Cb 1.74 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.51 1tvv h ALA 134 CO -0.00 0.30 -0.09 0.35 0.00 0.00 0.00 179.25 179.81 1tvv h PHE 135 N 0.06 -0.22 -0.57 0.00 3.57 -0.93 -2.52 116.94 116.33 1tvv h PHE 135 Ca -0.02 -0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.60 1tvv h PHE 135 Cb 1.02 0.07 -0.10 0.00 2.79 0.00 0.00 35.95 39.74 1tvv h PHE 135 CO 0.11 -0.06 0.00 0.00 -2.23 0.00 0.00 178.31 176.13 1tvv h ALA 136 N 0.47 0.56 -0.77 2.41 0.00 -1.16 0.11 119.26 120.88 1tvv h ALA 136 Ca -0.02 0.17 0.21 0.00 0.00 0.00 0.00 54.91 55.27 1tvv h ALA 136 Cb 0.26 0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 1tvv h ALA 136 CO 0.04 -0.39 0.54 0.00 0.00 0.00 0.00 179.25 179.45 1tvv h ALA 137 N 1.52 2.62 0.00 0.00 0.00 -0.92 -0.52 119.26 121.96 1tvv h ALA 137 Ca 0.30 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1tvv h ALA 137 Cb 0.47 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1tvv h ALA 137 CO -0.48 -0.84 -0.63 0.36 0.00 0.00 0.00 179.25 177.66 1tvv n LYS 138 N -4.34 3.37 0.00 0.00 2.85 0.12 -4.60 118.16 115.56 1tvv n LYS 138 Ca 0.15 -0.02 0.00 0.00 -1.05 0.00 0.00 58.31 57.40 1tvv n LYS 138 Cb 0.79 -0.93 0.00 0.00 -0.65 0.00 0.00 35.03 34.24 1tvv n LYS 138 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1tvv n TYR 139 N -1.34 0.00 0.53 5.58 4.01 0.14 -4.71 117.16 121.38 1tvv n TYR 139 Ca 0.01 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.86 1tvv n TYR 139 Cb 0.13 0.00 0.11 0.00 -0.31 0.00 0.00 39.34 39.27 1tvv n TYR 139 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1tvv n GLY 140 N 2.36 -1.34 3.55 2.72 0.00 -0.22 -4.73 105.19 107.53 1tvv n GLY 140 Ca 0.00 -0.30 -0.43 0.00 0.00 0.00 0.00 46.02 45.29 1tvv n GLY 140 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1tvv s ASP 141 N -4.20 6.39 0.26 1.61 -1.08 -1.20 -0.20 116.67 118.26 1tvv s ASP 141 Ca 0.05 -0.15 0.23 0.00 -0.52 0.00 0.00 52.55 52.17 1tvv s ASP 141 Cb 0.13 -2.48 0.99 0.00 -1.46 0.00 0.00 42.92 40.11 1tvv s ASP 141 CO 0.75 -1.30 1.71 0.18 0.52 0.00 0.00 175.17 177.04 1tvv n LEU 142 N 7.77 0.67 0.00 -1.34 4.77 0.03 -4.96 117.00 123.94 1tvv n LEU 142 Ca 0.05 0.67 0.00 0.00 -0.03 0.00 0.00 56.01 56.70 1tvv n LEU 142 Cb 0.48 -0.59 0.00 0.00 -2.33 0.00 0.00 43.42 40.98 1tvv n LEU 142 CO 0.66 -0.59 0.00 0.61 -1.33 0.00 0.00 177.39 176.75 1tvv n GLY 143 N -0.08 1.52 3.48 -0.72 0.00 -1.26 -4.73 105.19 103.41 1tvv n GLY 143 Ca 0.02 -0.44 -0.43 0.00 0.00 0.00 0.00 46.02 45.17 1tvv n GLY 143 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tvv s LEU 144 N 0.00 4.47 0.24 0.99 1.02 -1.26 -4.75 118.68 119.39 1tvv s LEU 144 Ca 0.00 -1.62 0.02 0.00 0.02 0.00 0.00 54.13 52.55 1tvv s LEU 144 Cb 0.00 -2.45 -0.05 0.00 0.02 0.00 0.00 46.19 43.71 1tvv s LEU 144 CO 0.00 -1.28 0.04 -0.69 0.02 0.00 0.00 176.35 174.44 1tvv s VAL 145 N 3.64 0.81 0.38 -1.59 1.01 -1.26 -5.01 120.40 118.37 1tvv s VAL 145 Ca 0.34 -2.01 0.20 0.00 0.00 0.00 0.00 61.98 60.51 1tvv s VAL 145 Cb -0.06 -2.46 0.38 0.00 0.00 0.00 0.00 36.38 34.24 1tvv s VAL 145 CO -0.05 -0.20 1.65 1.88 0.00 0.00 0.00 175.10 178.38 1tvv h TYR 146 N 2.44 0.78 -0.71 5.22 0.05 -1.93 0.56 116.97 123.38 1tvv h TYR 146 Ca -0.38 0.03 0.08 0.00 0.05 0.00 0.00 58.73 58.51 1tvv h TYR 146 Cb 1.23 -0.20 -0.07 0.00 1.01 0.00 0.00 36.73 38.70 1tvv h TYR 146 CO 0.52 -0.22 0.37 0.78 -1.05 0.00 0.00 178.16 178.57 1tvv h GLY 147 N 0.21 1.06 0.90 3.88 0.00 -1.79 0.16 103.07 107.49 1tvv h GLY 147 Ca 0.77 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 47.85 1tvv h GLY 147 CO -0.55 0.10 -0.69 -1.14 0.00 0.00 0.00 176.54 174.26 1tvv n SER 148 N -4.83 0.60 0.10 0.19 3.41 0.10 -2.77 113.62 110.43 1tvv n SER 148 Ca 0.11 -0.17 -0.21 0.00 -0.26 0.00 0.00 58.87 58.33 1tvv n SER 148 Cb 0.24 0.39 -0.15 0.00 -0.26 0.00 0.00 64.21 64.44 1tvv n SER 148 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1tvv h GLN 149 N 0.00 0.38 0.15 4.33 4.20 -0.75 -1.92 115.11 121.50 1tvv h GLN 149 Ca 0.00 -0.66 -0.28 0.00 0.06 0.00 0.00 58.65 57.77 1tvv h GLN 149 Cb 0.62 0.24 0.01 0.00 0.30 0.00 0.00 27.48 28.66 1tvv h GLN 149 CO 0.00 1.29 -1.27 -1.49 -0.67 0.00 0.00 178.83 176.69 1tvv h TRP 150 N 0.10 0.59 0.00 2.96 6.55 -1.10 -3.39 115.95 121.66 1tvv h TRP 150 Ca -0.25 -0.43 0.00 0.00 0.95 0.00 0.00 58.89 59.16 1tvv h TRP 150 Cb 2.08 -0.03 0.00 0.00 -0.86 0.00 0.00 29.16 30.36 1tvv h TRP 150 CO 0.09 1.33 -0.00 0.54 -1.05 0.00 0.00 178.44 179.35 1tvv n ARG 151 N -3.58 1.83 -2.69 0.49 1.74 -1.12 -0.87 116.66 112.46 1tvv n ARG 151 Ca -0.10 -2.22 -0.06 0.00 -0.77 0.00 0.00 57.85 54.70 1tvv n ARG 151 Cb 1.03 -1.33 0.09 0.00 -1.02 0.00 0.00 32.46 31.22 1tvv n ARG 151 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1tvv n ALA 152 N -1.13 -1.15 -2.20 7.54 0.00 -0.73 -4.31 120.51 118.53 1tvv n ALA 152 Ca 0.11 -0.99 -0.42 0.00 0.00 0.00 0.00 53.44 52.14 1tvv n ALA 152 Cb 0.51 -1.58 -0.03 0.00 0.00 0.00 0.00 19.45 18.35 1tvv n ALA 152 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1tvv s TRP 153 N 0.16 3.13 -0.13 0.00 -0.11 0.05 -4.67 118.94 117.36 1tvv s TRP 153 Ca 0.18 0.93 -0.29 0.00 1.22 0.00 0.00 56.10 58.14 1tvv s TRP 153 Cb 0.28 -3.66 -0.01 0.00 -1.50 0.00 0.00 33.47 28.58 1tvv s TRP 153 CO -0.09 -2.35 1.05 -1.01 -4.62 0.00 0.00 176.95 169.93 1tvv s HIS 154 N 1.48 3.41 0.49 5.86 3.76 -1.26 -0.87 115.29 128.15 1tvv s HIS 154 Ca 0.64 1.50 -0.01 0.00 -0.15 0.00 0.00 55.06 57.04 1tvv s HIS 154 Cb -0.35 -3.25 0.00 0.00 1.11 0.00 0.00 32.58 30.10 1tvv s HIS 154 CO 0.29 -0.46 0.72 0.95 -0.85 0.00 0.00 174.74 175.39 1tvv s THR 155 N 2.40 3.77 0.35 1.30 -4.23 -0.99 -4.97 115.64 113.27 1tvv s THR 155 Ca 0.48 -0.43 0.39 0.00 -1.18 0.00 0.00 61.69 60.95 1tvv s THR 155 Cb -0.18 -3.41 0.41 0.00 1.34 0.00 0.00 72.50 70.66 1tvv s THR 155 CO 0.15 -0.31 2.16 0.28 -0.54 0.00 0.00 174.62 176.36 1tvv h SER 156 N 0.26 0.00 -0.39 3.99 0.02 -1.96 -2.08 113.55 113.38 1tvv h SER 156 Ca -0.45 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 1tvv h SER 156 Cb 1.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.80 1tvv h SER 156 CO 0.57 0.00 0.00 0.29 -1.14 0.00 0.00 176.83 176.55 1tvv n LYS 157 N -3.04 3.66 -2.37 3.45 4.76 -1.26 -4.89 118.16 118.47 1tvv n LYS 157 Ca -0.01 -2.15 -0.16 0.00 -2.87 0.00 0.00 58.31 53.12 1tvv n LYS 157 Cb 0.18 -2.02 -0.00 0.00 -1.84 0.00 0.00 35.03 31.35 1tvv n LYS 157 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1tvv n GLY 158 N 0.44 -0.27 0.00 0.72 0.00 -0.78 -5.01 105.19 100.29 1tvv n GLY 158 Ca 0.19 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1tvv n GLY 158 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1tvv n ASP 159 N -1.04 1.27 -3.71 1.61 2.03 -1.25 -4.93 116.55 110.52 1tvv n ASP 159 Ca -0.17 -0.04 -0.12 0.00 0.52 0.00 0.00 54.79 54.98 1tvv n ASP 159 Cb 0.63 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.93 1tvv n ASP 159 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 1tvv s THR 160 N 1.31 -0.01 -0.10 5.18 2.01 -1.26 -2.35 115.64 120.42 1tvv s THR 160 Ca 0.00 0.04 0.01 0.00 0.31 0.00 0.00 61.69 62.05 1tvv s THR 160 Cb 0.00 -0.62 -0.02 0.00 0.01 0.00 0.00 72.50 71.87 1tvv s THR 160 CO 0.00 0.02 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.18 1tvv s ILE 161 N 0.75 3.03 -1.13 1.82 1.01 -0.05 -4.85 121.20 121.78 1tvv s ILE 161 Ca -0.04 -0.69 -0.07 0.00 0.00 0.00 0.00 60.65 59.84 1tvv s ILE 161 Cb -0.05 -2.24 0.27 0.00 0.01 0.00 0.00 42.46 40.45 1tvv s ILE 161 CO -0.05 0.55 1.41 -0.67 0.00 0.00 0.00 174.94 176.18 1tvv n ASP 162 N 3.04 5.87 -0.26 3.58 2.03 -1.26 -0.77 116.55 128.78 1tvv n ASP 162 Ca -0.18 -3.22 -0.10 0.00 0.52 0.00 0.00 54.79 51.82 1tvv n ASP 162 Cb 0.52 -1.36 -0.06 0.00 -0.72 0.00 0.00 41.12 39.51 1tvv n ASP 162 CO 0.00 0.00 0.00 1.56 -1.92 0.00 0.00 177.20 176.84 1tvv h GLN 163 N 6.00 -0.19 -0.45 -0.67 4.20 -1.59 0.47 115.11 122.90 1tvv h GLN 163 Ca 0.23 0.01 0.04 0.00 0.06 0.00 0.00 58.65 58.99 1tvv h GLN 163 Cb 0.72 0.04 -0.04 0.00 0.30 0.00 0.00 27.48 28.50 1tvv h GLN 163 CO 1.26 -0.13 0.22 1.25 -0.67 0.00 0.00 178.83 180.77 1tvv h LEU 164 N -0.20 0.31 -0.51 1.46 6.46 -1.35 -0.33 115.31 121.17 1tvv h LEU 164 Ca 0.16 0.02 0.05 0.00 -0.12 0.00 0.00 57.88 58.00 1tvv h LEU 164 Cb 0.54 -0.03 -0.05 0.00 -0.73 0.00 0.00 40.66 40.39 1tvv h LEU 164 CO -0.76 0.22 0.24 1.23 -0.62 0.00 0.00 178.44 178.76 1tvv h GLY 165 N 0.44 0.71 0.73 3.75 0.00 -1.34 -1.71 103.07 105.64 1tvv h GLY 165 Ca 0.19 -0.16 -0.03 0.00 0.00 0.00 0.00 47.33 47.33 1tvv h GLY 165 CO -0.14 0.08 -0.05 -0.55 0.00 0.00 0.00 176.54 175.89 1tvv h ASP 166 N 0.46 0.26 -0.88 0.19 3.32 -0.46 -2.72 116.42 116.59 1tvv h ASP 166 Ca 0.23 -0.39 0.11 0.00 0.02 0.00 0.00 57.03 56.99 1tvv h ASP 166 Cb 0.17 -0.07 -0.08 0.00 0.22 0.00 0.00 39.33 39.57 1tvv h ASP 166 CO -0.18 0.59 0.52 0.58 -1.72 0.00 0.00 179.24 179.03 1tvv h VAL 167 N -0.08 0.90 -0.25 -1.35 2.07 -0.82 -0.40 116.25 116.32 1tvv h VAL 167 Ca 0.03 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.26 1tvv h VAL 167 Cb 0.49 -0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.23 1tvv h VAL 167 CO 0.02 0.15 0.16 0.40 0.02 0.00 0.00 177.57 178.32 1tvv h ILE 168 N 0.84 1.06 -0.81 4.57 2.04 -1.24 -0.58 117.51 123.39 1tvv h ILE 168 Ca 0.43 -0.11 0.08 0.00 1.00 0.00 0.00 64.86 66.26 1tvv h ILE 168 Cb 0.42 0.70 -0.05 0.00 -0.74 0.00 0.00 36.82 37.15 1tvv h ILE 168 CO -0.26 0.06 0.53 -0.08 0.00 0.00 0.00 178.15 178.40 1tvv h GLU 169 N 0.33 0.81 -0.28 2.37 4.57 -0.81 -1.43 114.58 120.14 1tvv h GLU 169 Ca 0.09 -0.05 -0.14 0.00 -1.18 0.00 0.00 59.36 58.09 1tvv h GLU 169 Cb -0.04 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 28.36 1tvv h GLU 169 CO -0.02 0.54 -0.38 1.96 -1.18 0.00 0.00 179.01 179.92 1tvv h GLN 170 N 0.83 0.65 -0.59 1.92 1.08 -0.18 -2.42 115.11 116.40 1tvv h GLN 170 Ca 0.36 -0.33 0.00 0.00 -1.45 0.00 0.00 58.65 57.24 1tvv h GLN 170 Cb 0.31 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.71 1tvv h GLN 170 CO -0.13 0.93 0.39 0.82 -0.95 0.00 0.00 178.83 179.88 1tvv h ILE 171 N 0.54 1.16 -0.24 2.54 2.04 -0.03 0.71 117.51 124.23 1tvv h ILE 171 Ca 0.05 -0.29 -0.12 0.00 1.00 0.00 0.00 64.86 65.49 1tvv h ILE 171 Cb 0.90 0.29 -0.00 0.00 -0.74 0.00 0.00 36.82 37.27 1tvv h ILE 171 CO 0.08 0.15 -0.32 0.11 0.00 0.00 0.00 178.15 178.18 1tvv h LYS 172 N 0.81 0.64 0.15 2.37 1.57 -1.24 -2.93 116.57 117.94 1tvv h LYS 172 Ca 0.22 -0.37 -0.33 0.00 -1.87 0.00 0.00 60.65 58.30 1tvv h LYS 172 Cb -0.08 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.26 1tvv h LYS 172 CO -0.05 0.98 -1.67 1.79 -0.57 0.00 0.00 179.45 179.93 1tvv h THR 173 N 0.35 1.01 -2.18 -0.16 1.35 -0.99 -3.42 112.91 108.87 1tvv h THR 173 Ca 0.03 -2.62 -0.58 0.00 -0.55 0.00 0.00 66.41 62.69 1tvv h THR 173 Cb 0.90 2.74 -0.39 0.00 -1.73 0.00 0.00 68.15 69.67 1tvv h THR 173 CO 0.07 0.83 -1.01 1.41 -0.25 0.00 0.00 175.52 176.57 1tvv n HIS 174 N -3.52 -0.20 -0.37 4.73 8.25 0.24 -5.00 115.22 119.37 1tvv n HIS 174 Ca -0.21 -3.53 0.02 0.00 -0.26 0.00 0.00 57.72 53.73 1tvv n HIS 174 Cb 1.06 -0.16 0.16 0.00 1.12 0.00 0.00 29.99 32.18 1tvv n HIS 174 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1tvv h PRO 175 N 4.63 1.18 -0.48 -0.41 0.13 -1.59 -2.17 132.00 133.29 1tvv h PRO 175 Ca 0.15 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 1tvv h PRO 175 Cb 0.87 -0.27 0.00 0.00 0.13 0.00 0.00 31.00 31.74 1tvv h PRO 175 CO 0.46 0.78 0.00 0.66 -0.23 0.00 0.00 178.00 179.67 1tvv n TYR 176 N -4.47 0.00 -1.52 1.56 4.01 -1.26 -3.89 117.16 111.59 1tvv n TYR 176 Ca 0.15 0.00 -0.32 0.00 -0.16 0.00 0.00 57.90 57.56 1tvv n TYR 176 Cb 0.14 -0.05 0.07 0.00 -0.31 0.00 0.00 39.34 39.20 1tvv n TYR 176 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1tvv s SER 177 N -0.56 4.71 0.00 7.72 0.15 -0.82 -4.96 113.70 119.94 1tvv s SER 177 Ca 0.00 2.00 0.04 0.00 0.70 0.00 0.00 55.95 58.69 1tvv s SER 177 Cb 0.00 -2.55 0.12 0.00 -1.71 0.00 0.00 66.02 61.88 1tvv s SER 177 CO 0.00 -1.90 1.09 0.54 1.20 0.00 0.00 173.24 174.18 1tvv n ARG 178 N -2.87 2.90 -0.48 5.44 1.74 -1.26 -4.58 116.66 117.54 1tvv n ARG 178 Ca 0.10 -1.71 0.08 0.00 -0.77 0.00 0.00 57.85 55.56 1tvv n ARG 178 Cb 0.52 -1.11 0.27 0.00 -1.02 0.00 0.00 32.46 31.13 1tvv n ARG 178 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1tvv n ARG 179 N -0.09 3.18 -1.65 5.56 3.00 -1.26 -4.83 116.66 120.57 1tvv n ARG 179 Ca 0.05 -2.82 -0.42 0.00 -0.01 0.00 0.00 57.85 54.64 1tvv n ARG 179 Cb 0.32 -1.85 -0.01 0.00 0.00 0.00 0.00 32.46 30.92 1tvv n ARG 179 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1tvv n LEU 180 N -0.25 6.54 -4.24 0.55 4.32 -1.26 -4.90 117.00 117.76 1tvv n LEU 180 Ca 0.21 -3.98 -0.29 0.00 -0.02 0.00 0.00 56.01 51.93 1tvv n LEU 180 Cb 0.89 -1.59 -0.16 0.00 -1.62 0.00 0.00 43.42 40.94 1tvv n LEU 180 CO 0.17 0.93 -0.54 -0.63 -1.22 0.00 0.00 177.39 176.10 1tvv s ILE 181 N 3.42 1.80 -0.14 -0.08 1.01 -1.26 -0.39 121.20 125.54 1tvv s ILE 181 Ca 0.48 -0.96 0.01 0.00 0.00 0.00 0.00 60.65 60.19 1tvv s ILE 181 Cb 0.14 -1.50 0.02 0.00 0.01 0.00 0.00 42.46 41.12 1tvv s ILE 181 CO -0.06 0.51 -0.18 -0.69 0.00 0.00 0.00 174.94 174.51 1tvv s VAL 182 N -0.37 1.81 0.02 2.92 1.01 -0.68 -5.00 120.40 120.11 1tvv s VAL 182 Ca 0.04 -0.81 0.02 0.00 0.00 0.00 0.00 61.98 61.23 1tvv s VAL 182 Cb -0.10 -1.64 -0.04 0.00 0.00 0.00 0.00 36.38 34.60 1tvv s VAL 182 CO 0.01 0.50 -0.00 -0.55 0.00 0.00 0.00 175.10 175.05 1tvv s SER 183 N 1.11 5.07 -0.06 3.32 0.15 -1.26 -2.59 113.70 119.45 1tvv s SER 183 Ca -0.02 -0.05 0.10 0.00 0.70 0.00 0.00 55.95 56.68 1tvv s SER 183 Cb -0.14 -1.30 0.23 0.00 -1.71 0.00 0.00 66.02 63.11 1tvv s SER 183 CO -0.06 0.26 1.17 0.00 1.20 0.00 0.00 173.24 175.81 1tvv n ALA 184 N 1.24 2.27 -3.04 5.45 0.00 -0.73 -4.71 120.51 121.00 1tvv n ALA 184 Ca -0.14 -1.61 -0.38 0.00 0.00 0.00 0.00 53.44 51.31 1tvv n ALA 184 Cb 0.52 -0.32 -0.12 0.00 0.00 0.00 0.00 19.45 19.54 1tvv n ALA 184 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1tvv s TRP 185 N -1.72 3.19 -0.25 0.00 -0.11 -1.26 -4.67 118.94 114.12 1tvv s TRP 185 Ca 0.20 -0.95 0.01 0.00 1.22 0.00 0.00 56.10 56.58 1tvv s TRP 185 Cb 0.15 -2.32 0.05 0.00 -1.50 0.00 0.00 33.47 29.85 1tvv s TRP 185 CO 0.06 -0.59 -0.10 1.21 -4.62 0.00 0.00 176.95 172.92 1tvv s ASN 186 N 1.52 4.30 0.60 5.86 3.84 -1.26 -4.98 114.94 124.83 1tvv s ASN 186 Ca 0.02 -1.19 0.32 0.00 0.21 0.00 0.00 52.86 52.22 1tvv s ASN 186 Cb -0.18 -1.58 1.89 0.00 -0.55 0.00 0.00 41.25 40.83 1tvv s ASN 186 CO 0.04 -0.16 2.26 -0.65 -2.79 0.00 0.00 177.10 175.80 1tvv h PRO 187 N 7.87 0.00 -0.10 0.43 0.11 -2.01 -0.99 132.00 137.31 1tvv h PRO 187 Ca -0.25 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.68 1tvv h PRO 187 Cb 1.07 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 1tvv h PRO 187 CO 0.51 0.00 -0.67 1.49 -0.21 0.00 0.00 178.00 179.12 1tvv h GLU 188 N 0.00 0.40 0.06 1.05 4.81 -2.03 -3.38 114.58 115.49 1tvv h GLU 188 Ca 0.01 -0.30 -0.33 0.00 -0.13 0.00 0.00 59.36 58.61 1tvv h GLU 188 Cb 0.05 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.46 1tvv h GLU 188 CO -0.00 0.93 -1.80 -0.25 -0.73 0.00 0.00 179.01 177.16 1tvv n ASP 189 N -3.87 2.01 -0.33 1.04 8.00 -0.63 -4.52 116.55 118.24 1tvv n ASP 189 Ca -0.04 0.27 0.22 0.00 0.71 0.00 0.00 54.79 55.96 1tvv n ASP 189 Cb 0.67 -0.87 0.45 0.00 -0.02 0.00 0.00 41.12 41.35 1tvv n ASP 189 CO 0.00 0.00 0.00 -0.37 -0.39 0.00 0.00 177.20 176.44 1tvv h VAL 190 N -0.40 0.31 -1.01 2.53 -1.51 -1.40 -1.16 116.25 113.61 1tvv h VAL 190 Ca -0.43 -0.11 0.27 0.00 -1.23 0.00 0.00 66.70 65.20 1tvv h VAL 190 Cb 1.73 -0.04 -0.07 0.00 -2.13 0.00 0.00 31.29 30.78 1tvv h VAL 190 CO -0.07 0.06 0.69 1.55 -1.23 0.00 0.00 177.57 178.56 1tvv h PRO 191 N 0.32 0.23 -1.40 5.19 0.13 -1.79 -2.55 132.00 132.13 1tvv h PRO 191 Ca 0.71 -0.01 -0.53 0.00 -0.87 0.00 0.00 66.00 65.30 1tvv h PRO 191 Cb 1.59 -0.05 -0.41 0.00 0.13 0.00 0.00 31.00 32.25 1tvv h PRO 191 CO -0.61 0.15 -0.86 0.25 -0.23 0.00 0.00 178.00 176.71 1tvv n THR 192 N -4.44 1.99 -4.14 1.56 -2.24 -0.44 -5.06 114.28 101.51 1tvv n THR 192 Ca 0.23 -4.44 -0.29 0.00 -2.27 0.00 0.00 64.05 57.28 1tvv n THR 192 Cb 0.93 -0.74 -0.08 0.00 -2.10 0.00 0.00 70.33 68.34 1tvv n THR 192 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 1tvv s MET 193 N -3.42 2.55 0.12 -0.78 -1.94 -0.96 -5.00 119.30 109.87 1tvv s MET 193 Ca 0.42 -0.92 -0.14 0.00 -1.71 0.00 0.00 55.69 53.34 1tvv s MET 193 Cb 0.41 -2.50 -0.03 0.00 2.01 0.00 0.00 34.83 34.72 1tvv s MET 193 CO -0.13 0.51 1.53 0.00 -0.01 0.00 0.00 175.02 176.93 1tvv h ALA 194 N 3.10 0.53 -1.67 3.03 0.00 -1.94 -3.42 119.26 118.88 1tvv h ALA 194 Ca -0.47 -0.30 -0.17 0.00 0.00 0.00 0.00 54.91 53.96 1tvv h ALA 194 Cb 1.18 -0.14 -0.28 0.00 0.00 0.00 0.00 17.79 18.55 1tvv h ALA 194 CO 0.60 0.38 -0.52 -1.17 0.00 0.00 0.00 179.25 178.54 1tvv s LEU 195 N -9.29 -0.83 0.58 0.00 2.96 -1.26 -5.15 118.68 105.69 1tvv s LEU 195 Ca -0.13 -0.30 -0.20 0.00 -0.22 0.00 0.00 54.13 53.29 1tvv s LEU 195 Cb 0.10 1.17 -0.05 0.00 0.50 0.00 0.00 46.19 47.91 1tvv s LEU 195 CO 0.81 -0.35 1.12 -2.65 -1.32 0.00 0.00 176.35 173.97 1tvv n PRO 196 N 5.36 1.18 -1.68 0.98 -0.02 -1.26 -4.86 135.00 134.70 1tvv n PRO 196 Ca 0.01 0.45 -0.45 0.00 -2.02 0.00 0.00 63.50 61.49 1tvv n PRO 196 Cb 0.50 -2.32 -0.04 0.00 -0.02 0.00 0.00 33.50 31.62 1tvv n PRO 196 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1tvv n PRO 197 N -1.05 2.49 0.09 0.52 -0.02 -1.26 -4.89 135.00 130.87 1tvv n PRO 197 Ca 0.13 0.90 -0.05 0.00 -2.02 0.00 0.00 63.50 62.46 1tvv n PRO 197 Cb 0.46 -2.75 0.01 0.00 -0.02 0.00 0.00 33.50 31.19 1tvv n PRO 197 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1tvv n HIS 199 N -3.56 3.15 -0.09 0.00 8.25 -1.26 -1.70 115.22 120.00 1tvv n HIS 199 Ca -0.01 -2.87 -0.07 0.00 -0.26 0.00 0.00 57.72 54.51 1tvv n HIS 199 Cb 0.80 -1.78 0.00 0.00 1.12 0.00 0.00 29.99 30.13 1tvv n HIS 199 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 1tvv h THR 200 N 3.76 0.93 -1.93 1.59 2.02 -1.45 -3.43 112.91 114.40 1tvv h THR 200 Ca 0.32 -0.10 -0.02 0.00 0.77 0.00 0.00 66.41 67.39 1tvv h THR 200 Cb 0.67 0.63 -0.22 0.00 -1.74 0.00 0.00 68.15 67.49 1tvv h THR 200 CO 1.47 0.05 0.18 -0.22 0.37 0.00 0.00 175.52 177.37 1tvv s LEU 201 N -10.28 -0.71 0.10 2.58 0.20 -1.12 -1.76 118.68 107.68 1tvv s LEU 201 Ca -0.13 1.36 0.04 0.00 0.69 0.00 0.00 54.13 56.09 1tvv s LEU 201 Cb 0.11 2.37 -0.04 0.00 -0.43 0.00 0.00 46.19 48.21 1tvv s LEU 201 CO 0.71 -0.23 -0.11 -0.72 -0.29 0.00 0.00 176.35 175.71 1tvv s TYR 202 N 0.41 1.09 -0.01 5.38 1.13 -1.07 0.82 117.35 125.11 1tvv s TYR 202 Ca 0.00 -0.63 0.01 0.00 -1.41 0.00 0.00 57.07 55.03 1tvv s TYR 202 Cb -0.05 -0.59 0.00 0.00 -1.10 0.00 0.00 41.96 40.22 1tvv s TYR 202 CO -0.01 0.01 -0.03 -1.14 -2.51 0.00 0.00 175.55 171.88 1tvv s GLN 203 N -2.71 0.26 0.45 -3.49 0.74 -0.05 -1.69 119.66 113.19 1tvv s GLN 203 Ca 0.05 -0.08 0.01 0.00 0.05 0.00 0.00 55.36 55.39 1tvv s GLN 203 Cb -0.03 -0.28 0.00 0.00 1.10 0.00 0.00 33.01 33.79 1tvv s GLN 203 CO 0.00 0.04 0.67 -0.06 -0.55 0.00 0.00 175.29 175.39 1tvv s PHE 204 N 0.09 3.16 -0.16 1.67 0.08 0.47 -1.39 117.98 121.90 1tvv s PHE 204 Ca -0.01 0.15 -0.25 0.00 0.12 0.00 0.00 56.93 56.94 1tvv s PHE 204 Cb -0.03 -2.35 0.06 0.00 -0.57 0.00 0.00 43.02 40.13 1tvv s PHE 204 CO -0.00 -0.40 0.64 -0.47 -0.10 0.00 0.00 175.22 174.88 1tvv s TYR 205 N -2.55 -0.66 -0.04 0.36 6.14 -0.78 -4.64 117.35 115.19 1tvv s TYR 205 Ca 0.49 1.42 0.01 0.00 0.64 0.00 0.00 57.07 59.63 1tvv s TYR 205 Cb -0.10 0.29 0.02 0.00 0.42 0.00 0.00 41.96 42.60 1tvv s TYR 205 CO 0.37 -0.44 -0.03 0.08 0.64 0.00 0.00 175.55 176.17 1tvv s VAL 206 N -0.33 0.40 -0.27 3.14 1.01 -1.25 -0.94 120.40 122.15 1tvv s VAL 206 Ca -0.05 -0.04 -0.24 0.00 0.00 0.00 0.00 61.98 61.65 1tvv s VAL 206 Cb -0.03 -0.45 0.08 0.00 0.00 0.00 0.00 36.38 35.98 1tvv s VAL 206 CO 0.04 0.20 0.77 0.21 0.00 0.00 0.00 175.10 176.32 1tvv s ASN 207 N 0.98 -0.71 -1.43 3.32 2.47 -0.91 -4.58 114.94 114.08 1tvv s ASN 207 Ca -0.10 1.36 -0.10 0.00 0.42 0.00 0.00 52.86 54.44 1tvv s ASN 207 Cb -0.14 1.38 0.03 0.00 -1.45 0.00 0.00 41.25 41.07 1tvv s ASN 207 CO -0.01 -0.23 1.03 0.47 -3.72 0.00 0.00 177.10 174.64 1tvv n ASP 208 N 2.71 -5.90 -0.64 -4.21 8.00 -1.26 -1.38 116.55 113.87 1tvv n ASP 208 Ca -0.14 -0.55 -0.08 0.00 0.71 0.00 0.00 54.79 54.72 1tvv n ASP 208 Cb 0.55 -4.68 -0.04 0.00 -0.02 0.00 0.00 41.12 36.94 1tvv n ASP 208 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1tvv n GLY 209 N -1.83 0.84 3.41 0.44 0.00 -1.26 -4.96 105.19 101.82 1tvv n GLY 209 Ca -0.00 -0.06 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 1tvv n GLY 209 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tvv s LYS 210 N -2.58 2.53 -0.19 1.61 1.02 -0.48 -0.53 119.74 121.12 1tvv s LYS 210 Ca 0.00 -0.77 -0.09 0.00 0.02 0.00 0.00 55.97 55.13 1tvv s LYS 210 Cb 0.00 -2.31 -0.05 0.00 -0.52 0.00 0.00 37.83 34.95 1tvv s LYS 210 CO 0.00 0.54 0.12 -1.17 -0.92 0.00 0.00 175.35 173.91 1tvv s LEU 211 N -0.52 4.14 0.33 3.17 2.96 0.58 -2.14 118.68 127.21 1tvv s LEU 211 Ca 0.07 0.21 0.10 0.00 -0.22 0.00 0.00 54.13 54.29 1tvv s LEU 211 Cb -0.11 -2.07 -0.06 0.00 0.50 0.00 0.00 46.19 44.45 1tvv s LEU 211 CO 0.01 0.18 -0.09 -0.44 -1.32 0.00 0.00 176.35 174.69 1tvv s SER 212 N 0.33 3.82 -0.14 3.68 0.01 -0.11 -0.49 113.70 120.79 1tvv s SER 212 Ca 0.07 -1.11 -0.10 0.00 1.31 0.00 0.00 55.95 56.13 1tvv s SER 212 Cb -0.11 -0.39 0.05 0.00 0.21 0.00 0.00 66.02 65.77 1tvv s SER 212 CO -0.02 -0.15 0.36 -0.22 0.41 0.00 0.00 173.24 173.62 1tvv s LEU 213 N -3.61 0.29 -0.06 2.44 0.20 -1.12 -1.87 118.68 114.95 1tvv s LEU 213 Ca 0.32 0.76 0.04 0.00 0.69 0.00 0.00 54.13 55.94 1tvv s LEU 213 Cb 0.00 1.19 -0.02 0.00 -0.43 0.00 0.00 46.19 46.93 1tvv s LEU 213 CO 0.17 -0.16 -0.18 -1.58 -0.29 0.00 0.00 176.35 174.31 1tvv s GLN 214 N 0.89 2.61 -0.05 1.98 0.74 -0.49 -1.18 119.66 124.17 1tvv s GLN 214 Ca -0.06 -0.77 0.06 0.00 0.05 0.00 0.00 55.36 54.64 1tvv s GLN 214 Cb -0.06 -2.33 -0.01 0.00 1.10 0.00 0.00 33.01 31.71 1tvv s GLN 214 CO -0.07 0.49 -0.23 -1.17 -0.55 0.00 0.00 175.29 173.76 1tvv s LEU 215 N -0.41 2.03 -0.33 3.68 1.98 -0.53 -0.87 118.68 124.23 1tvv s LEU 215 Ca 0.04 -0.47 -0.08 0.00 -2.89 0.00 0.00 54.13 50.74 1tvv s LEU 215 Cb -0.12 -1.26 0.02 0.00 0.66 0.00 0.00 46.19 45.49 1tvv s LEU 215 CO 0.02 0.23 0.12 -0.47 -1.89 0.00 0.00 176.35 174.36 1tvv s TYR 216 N -0.17 3.21 -0.37 5.38 6.14 0.24 -1.24 117.35 130.55 1tvv s TYR 216 Ca -0.02 -1.12 -0.09 0.00 0.64 0.00 0.00 57.07 56.48 1tvv s TYR 216 Cb -0.13 -2.31 0.04 0.00 0.42 0.00 0.00 41.96 39.98 1tvv s TYR 216 CO 0.03 -0.64 0.18 -1.14 0.64 0.00 0.00 175.55 174.62 1tvv s GLN 217 N 1.48 2.71 0.48 4.97 0.74 -0.51 -1.87 119.66 127.67 1tvv s GLN 217 Ca 0.01 -1.19 0.13 0.00 0.05 0.00 0.00 55.36 54.36 1tvv s GLN 217 Cb -0.19 -3.66 1.13 0.00 1.10 0.00 0.00 33.01 31.40 1tvv s GLN 217 CO 0.04 -0.74 2.11 0.07 -0.55 0.00 0.00 175.29 176.21 1tvv h ARG 218 N 8.36 0.15 -3.08 1.67 0.11 -1.63 0.12 114.38 120.08 1tvv h ARG 218 Ca -0.24 -0.01 -0.17 0.00 0.10 0.00 0.00 59.98 59.66 1tvv h ARG 218 Cb 1.09 -0.03 -0.26 0.00 1.11 0.00 0.00 29.97 31.87 1tvv h ARG 218 CO 0.66 0.12 -0.43 0.45 0.10 0.00 0.00 179.97 180.88 1tvv s SER 219 N -6.96 -0.27 -0.03 0.08 0.15 -1.26 -0.69 113.70 104.72 1tvv s SER 219 Ca -0.06 0.53 -0.02 0.00 0.70 0.00 0.00 55.95 57.10 1tvv s SER 219 Cb 0.17 0.51 0.01 0.00 -1.71 0.00 0.00 66.02 64.99 1tvv s SER 219 CO 0.69 -0.11 0.07 0.00 1.20 0.00 0.00 173.24 175.09 1tvv s ALA 220 N 0.41 -0.17 -0.49 5.45 0.00 -0.54 -4.83 121.76 121.60 1tvv s ALA 220 Ca -0.02 0.20 -0.15 0.00 0.00 0.00 0.00 51.96 51.98 1tvv s ALA 220 Cb -0.04 -0.11 0.09 0.00 0.00 0.00 0.00 23.12 23.05 1tvv s ALA 220 CO -0.02 -0.03 0.41 0.34 0.00 0.00 0.00 175.76 176.46 1tvv s ASP 221 N 0.03 6.13 0.30 0.00 -1.08 -1.26 -1.57 116.67 119.23 1tvv s ASP 221 Ca -0.00 -1.45 0.01 0.00 -0.52 0.00 0.00 52.55 50.60 1tvv s ASP 221 Cb -0.01 -2.18 0.54 0.00 -1.46 0.00 0.00 42.92 39.82 1tvv s ASP 221 CO 0.00 -0.69 1.91 0.40 0.52 0.00 0.00 175.17 177.31 1tvv h ILE 222 N 5.80 1.05 0.08 4.11 2.04 -1.40 -0.39 117.51 128.81 1tvv h ILE 222 Ca -0.28 -0.35 -0.00 0.00 1.00 0.00 0.00 64.86 65.23 1tvv h ILE 222 Cb 1.11 -0.04 0.00 0.00 -0.74 0.00 0.00 36.82 37.14 1tvv h ILE 222 CO 0.91 0.18 -0.04 0.15 0.00 0.00 0.00 178.15 179.36 1tvv h PHE 223 N 1.01 -0.10 0.11 1.37 3.57 -1.93 -3.38 116.94 117.60 1tvv h PHE 223 Ca 0.39 -0.00 -0.28 0.00 3.53 0.00 0.00 57.97 61.61 1tvv h PHE 223 Cb 0.22 0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.99 1tvv h PHE 223 CO -0.00 0.33 -1.44 -0.07 -2.23 0.00 0.00 178.31 174.90 1tvv h LEU 224 N -0.96 0.36 0.13 0.59 3.38 -1.97 -3.41 115.31 113.42 1tvv h LEU 224 Ca -0.01 -0.84 -0.01 0.00 0.09 0.00 0.00 57.88 57.11 1tvv h LEU 224 Cb 0.47 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1tvv h LEU 224 CO 0.02 1.63 -0.06 1.23 0.09 0.00 0.00 178.44 181.34 1tvv h GLY 225 N 0.09 -0.18 -0.80 0.83 0.00 -1.37 -3.38 103.07 98.26 1tvv h GLY 225 Ca -0.31 0.07 0.27 0.00 0.00 0.00 0.00 47.33 47.35 1tvv h GLY 225 CO 0.05 -0.06 0.13 -2.08 0.00 0.00 0.00 176.54 174.57 1tvv h VAL 226 N -1.04 0.11 -0.90 4.60 2.07 -1.38 -0.62 116.25 119.09 1tvv h VAL 226 Ca -0.02 -0.02 0.11 0.00 0.82 0.00 0.00 66.70 67.59 1tvv h VAL 226 Cb 0.14 0.04 -0.08 0.00 -1.52 0.00 0.00 31.29 29.87 1tvv h VAL 226 CO 0.03 0.01 0.53 -0.65 0.02 0.00 0.00 177.57 177.51 1tvv h PRO 227 N 0.06 0.83 0.32 1.57 0.11 -1.77 -1.93 132.00 131.19 1tvv h PRO 227 Ca 0.60 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 66.64 1tvv h PRO 227 Cb 1.27 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1tvv h PRO 227 CO -0.83 0.55 -0.16 0.74 -0.21 0.00 0.00 178.00 178.10 1tvv h PHE 228 N 0.86 -0.40 -0.93 0.65 -1.00 -1.31 -3.32 116.94 111.49 1tvv h PHE 228 Ca 0.44 -0.01 0.18 0.00 2.81 0.00 0.00 57.97 61.40 1tvv h PHE 228 Cb 0.44 0.13 -0.18 0.00 3.61 0.00 0.00 35.95 39.96 1tvv h PHE 228 CO -0.04 -0.11 -0.25 0.00 -1.61 0.00 0.00 178.31 176.31 1tvv h ILE 230 N -0.00 0.42 -0.70 0.00 2.04 -1.49 0.57 117.51 118.34 1tvv h ILE 230 Ca 0.44 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.28 1tvv h ILE 230 Cb 0.67 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 37.14 1tvv h ILE 230 CO -0.96 0.00 0.37 0.00 0.00 0.00 0.00 178.15 177.56 1tvv h ALA 231 N 0.45 0.90 0.35 1.87 0.00 -1.24 0.10 119.26 121.69 1tvv h ALA 231 Ca 0.06 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1tvv h ALA 231 Cb 0.48 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1tvv h ALA 231 CO -0.23 0.44 -0.24 1.03 0.00 0.00 0.00 179.25 180.25 1tvv h SER 232 N 0.97 -0.60 0.77 0.00 0.87 -0.34 -0.20 113.55 115.03 1tvv h SER 232 Ca 0.24 0.04 -0.09 0.00 -1.23 0.00 0.00 61.79 60.75 1tvv h SER 232 Cb 0.07 0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.20 1tvv h SER 232 CO -0.04 -0.37 -0.44 1.88 -0.53 0.00 0.00 176.83 177.34 1tvv h TYR 233 N -0.57 0.00 -0.28 2.24 -1.99 -0.77 -2.77 116.97 112.83 1tvv h TYR 233 Ca -0.03 0.00 -0.12 0.00 2.00 0.00 0.00 58.73 60.57 1tvv h TYR 233 Cb 0.48 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.20 1tvv h TYR 233 CO -0.11 0.44 -0.34 0.00 -0.00 0.00 0.00 178.16 178.16 1tvv h ALA 234 N 1.56 0.90 -0.29 3.88 0.00 -0.63 -1.51 119.26 123.17 1tvv h ALA 234 Ca -0.00 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 1tvv h ALA 234 Cb 0.94 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1tvv h ALA 234 CO 0.06 0.63 0.16 1.25 0.00 0.00 0.00 179.25 181.34 1tvv h LEU 235 N 0.51 0.36 -0.93 0.00 5.85 -0.75 -2.39 115.31 117.96 1tvv h LEU 235 Ca 0.06 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.66 1tvv h LEU 235 Cb 0.82 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.73 1tvv h LEU 235 CO 0.07 0.34 0.38 0.25 -0.34 0.00 0.00 178.44 179.14 1tvv h LEU 236 N 0.35 1.05 -1.97 2.25 5.85 -1.36 0.13 115.31 121.61 1tvv h LEU 236 Ca 0.10 -0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.68 1tvv h LEU 236 Cb 0.06 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 40.82 1tvv h LEU 236 CO -0.02 0.88 -0.10 0.74 -0.34 0.00 0.00 178.44 179.61 1tvv h THR 237 N 1.14 0.79 0.22 1.05 2.02 -1.06 -1.28 112.91 115.78 1tvv h THR 237 Ca 0.28 -0.38 -0.29 0.00 0.77 0.00 0.00 66.41 66.79 1tvv h THR 237 Cb 0.12 1.22 0.03 0.00 -1.74 0.00 0.00 68.15 67.78 1tvv h THR 237 CO -0.03 0.10 -1.25 0.45 0.37 0.00 0.00 175.52 175.15 1tvv h HIS 238 N 0.00 0.83 0.83 3.16 3.86 -0.38 -3.10 115.15 120.35 1tvv h HIS 238 Ca -0.00 -0.61 -0.04 0.00 -1.16 0.00 0.00 60.37 58.56 1tvv h HIS 238 Cb 0.22 -0.03 0.01 0.00 1.06 0.00 0.00 27.41 28.66 1tvv h HIS 238 CO 0.00 1.48 -0.40 -0.07 0.86 0.00 0.00 177.93 179.80 1tvv h LEU 239 N -0.04 -0.95 -0.86 2.43 4.07 -0.34 -1.67 115.31 117.95 1tvv h LEU 239 Ca -0.22 0.03 0.14 0.00 0.08 0.00 0.00 57.88 57.92 1tvv h LEU 239 Cb 1.99 0.25 -0.09 0.00 1.08 0.00 0.00 40.66 43.88 1tvv h LEU 239 CO 0.23 -0.66 0.46 0.58 -1.08 0.00 0.00 178.44 177.97 1tvv h VAL 240 N -1.16 0.75 0.37 1.22 2.07 -1.42 -1.08 116.25 117.00 1tvv h VAL 240 Ca -0.11 -0.23 -0.02 0.00 0.82 0.00 0.00 66.70 67.16 1tvv h VAL 240 Cb 0.86 0.03 -0.00 0.00 -1.52 0.00 0.00 31.29 30.66 1tvv h VAL 240 CO 0.19 0.12 -0.21 0.00 0.02 0.00 0.00 177.57 177.69 1tvv h ALA 241 N 1.55 -0.54 -0.39 1.67 0.00 -1.50 0.80 119.26 120.86 1tvv h ALA 241 Ca 0.47 -0.11 0.08 0.00 0.00 0.00 0.00 54.91 55.35 1tvv h ALA 241 Cb 0.63 0.24 -0.09 0.00 0.00 0.00 0.00 17.79 18.58 1tvv h ALA 241 CO -0.35 -0.81 -0.21 1.25 0.00 0.00 0.00 179.25 179.13 1tvv h HIS 242 N -0.54 -0.55 0.12 0.00 6.17 -0.50 0.56 115.15 120.40 1tvv h HIS 242 Ca -0.04 0.05 0.02 0.00 0.71 0.00 0.00 60.37 61.10 1tvv h HIS 242 Cb 0.43 0.30 -0.03 0.00 2.52 0.00 0.00 27.41 30.63 1tvv h HIS 242 CO -0.07 -0.29 -0.23 1.49 0.71 0.00 0.00 177.93 179.53 1tvv h GLU 243 N -0.15 -0.41 0.00 5.26 4.57 -0.96 -1.72 114.58 121.17 1tvv h GLU 243 Ca 0.19 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.40 1tvv h GLU 243 Cb 0.44 0.09 0.00 0.00 -0.16 0.00 0.00 28.75 29.13 1tvv h GLU 243 CO -0.48 -0.28 0.00 0.00 -1.18 0.00 0.00 179.01 177.08 1tvv n GLY 245 N 0.43 0.07 2.13 0.00 0.00 0.18 -4.99 105.19 103.01 1tvv n GLY 245 Ca 0.08 -0.38 -0.13 0.00 0.00 0.00 0.00 46.02 45.59 1tvv n GLY 245 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1tvv n LEU 246 N -1.87 0.00 -4.93 0.99 4.32 -0.40 -5.01 117.00 110.11 1tvv n LEU 246 Ca -0.07 -1.52 -0.19 0.00 -0.02 0.00 0.00 56.01 54.21 1tvv n LEU 246 Cb 0.57 -0.10 -0.01 0.00 -1.62 0.00 0.00 43.42 42.26 1tvv n LEU 246 CO 0.20 -0.50 0.05 -1.61 -1.22 0.00 0.00 177.39 174.31 1tvv s GLU 247 N -3.32 2.68 -0.15 3.23 2.02 0.31 -4.42 118.70 119.05 1tvv s GLU 247 Ca 0.23 -1.39 -0.09 0.00 0.02 0.00 0.00 54.97 53.74 1tvv s GLU 247 Cb -0.02 -2.55 -0.04 0.00 0.10 0.00 0.00 34.13 31.62 1tvv s GLU 247 CO 0.15 -0.19 0.15 0.54 0.02 0.00 0.00 175.26 175.92 1tvv s VAL 248 N -2.40 5.45 0.00 2.63 0.11 -1.26 -0.31 120.40 124.62 1tvv s VAL 248 Ca 0.50 0.22 0.00 0.00 -2.93 0.00 0.00 61.98 59.78 1tvv s VAL 248 Cb -0.06 -3.44 0.00 0.00 -1.53 0.00 0.00 36.38 31.34 1tvv s VAL 248 CO 0.30 0.54 0.00 0.61 -3.33 0.00 0.00 175.10 173.21 1tvv n GLY 249 N 2.68 0.17 3.17 6.54 0.00 0.35 -4.43 105.19 113.67 1tvv n GLY 249 Ca -0.18 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.70 1tvv n GLY 249 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1tvv s GLU 250 N 1.81 0.82 -0.16 1.61 -1.05 -1.26 -0.07 118.70 120.40 1tvv s GLU 250 Ca 0.00 -1.12 -0.08 0.00 -0.15 0.00 0.00 54.97 53.62 1tvv s GLU 250 Cb 0.00 -0.52 -0.04 0.00 -0.44 0.00 0.00 34.13 33.13 1tvv s GLU 250 CO 0.00 0.08 0.12 0.12 0.95 0.00 0.00 175.26 176.53 1tvv s PHE 251 N -2.32 3.44 -0.20 4.83 5.36 0.07 -2.79 117.98 126.38 1tvv s PHE 251 Ca 0.04 0.36 0.01 0.00 -0.96 0.00 0.00 56.93 56.37 1tvv s PHE 251 Cb -0.04 -2.05 0.04 0.00 -0.34 0.00 0.00 43.02 40.63 1tvv s PHE 251 CO 0.00 0.44 -0.12 0.42 -1.46 0.00 0.00 175.22 174.50 1tvv s ILE 252 N -0.19 1.71 -0.41 3.12 1.01 -0.32 -0.34 121.20 125.78 1tvv s ILE 252 Ca 0.10 -1.01 -0.10 0.00 0.00 0.00 0.00 60.65 59.64 1tvv s ILE 252 Cb -0.12 -1.75 0.06 0.00 0.01 0.00 0.00 42.46 40.67 1tvv s ILE 252 CO 0.01 0.22 0.24 -2.28 0.00 0.00 0.00 174.94 173.13 1tvv s HIS 253 N 1.37 3.30 -0.14 3.97 2.46 -0.59 -1.46 115.29 124.20 1tvv s HIS 253 Ca -0.01 -1.32 -0.08 0.00 0.47 0.00 0.00 55.06 54.12 1tvv s HIS 253 Cb -0.16 -2.78 -0.04 0.00 -0.13 0.00 0.00 32.58 29.46 1tvv s HIS 253 CO -0.09 -0.78 0.15 0.99 -2.47 0.00 0.00 174.74 172.54 1tvv s THR 254 N 1.47 5.46 0.07 0.89 2.01 -0.37 -1.02 115.64 124.15 1tvv s THR 254 Ca 0.02 0.23 0.07 0.00 0.31 0.00 0.00 61.69 62.33 1tvv s THR 254 Cb -0.22 -3.44 -0.04 0.00 0.01 0.00 0.00 72.50 68.82 1tvv s THR 254 CO 0.04 0.56 -0.15 -0.36 -0.69 0.00 0.00 174.62 174.02 1tvv s PHE 255 N -0.61 2.64 0.00 4.92 0.08 0.11 -1.42 117.98 123.71 1tvv s PHE 255 Ca 0.13 -0.21 0.00 0.00 0.12 0.00 0.00 56.93 56.98 1tvv s PHE 255 Cb -0.12 -1.45 0.00 0.00 -0.57 0.00 0.00 43.02 40.88 1tvv s PHE 255 CO 0.03 0.34 0.00 0.41 -0.10 0.00 0.00 175.22 175.89 1tvv n GLY 256 N 1.19 0.13 3.41 4.36 0.00 0.41 -2.49 105.19 112.20 1tvv n GLY 256 Ca -0.15 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.43 1tvv n GLY 256 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1tvv s ASP 257 N -1.00 6.29 -0.20 1.61 -1.08 0.13 -1.60 116.67 120.82 1tvv s ASP 257 Ca 0.00 -1.47 -0.15 0.00 -0.52 0.00 0.00 52.55 50.40 1tvv s ASP 257 Cb 0.00 -2.35 -0.04 0.00 -1.46 0.00 0.00 42.92 39.07 1tvv s ASP 257 CO 0.00 -1.18 0.37 0.00 0.52 0.00 0.00 175.17 174.88 1tvv s ALA 258 N 2.98 3.56 0.18 3.66 0.00 -0.74 -1.46 121.76 129.93 1tvv s ALA 258 Ca 0.19 -0.55 0.00 0.00 0.00 0.00 0.00 51.96 51.60 1tvv s ALA 258 Cb -0.18 -2.58 -0.04 0.00 0.00 0.00 0.00 23.12 20.32 1tvv s ALA 258 CO 0.04 -0.24 0.06 -3.38 0.00 0.00 0.00 175.76 172.23 1tvv s HIS 259 N 1.18 1.15 -0.16 0.00 -3.43 -0.61 -1.07 115.29 112.35 1tvv s HIS 259 Ca 0.18 -1.17 -0.02 0.00 -0.80 0.00 0.00 55.06 53.24 1tvv s HIS 259 Cb -0.14 -0.64 0.05 0.00 -1.43 0.00 0.00 32.58 30.41 1tvv s HIS 259 CO 0.07 -0.40 0.02 -1.17 -2.00 0.00 0.00 174.74 171.26 1tvv s LEU 260 N -3.16 1.08 0.31 5.38 2.96 -0.31 -0.87 118.68 124.08 1tvv s LEU 260 Ca 0.29 -0.63 -0.30 0.00 -0.22 0.00 0.00 54.13 53.27 1tvv s LEU 260 Cb 0.07 -0.59 -0.11 0.00 0.50 0.00 0.00 46.19 46.06 1tvv s LEU 260 CO 0.06 -0.27 1.58 -0.31 -1.32 0.00 0.00 176.35 176.09 1tvv s TYR 261 N 1.86 2.71 0.56 5.38 2.02 -1.26 -1.50 117.35 127.12 1tvv s TYR 261 Ca 0.01 0.85 0.28 0.00 -0.37 0.00 0.00 57.07 57.83 1tvv s TYR 261 Cb -0.16 -4.07 1.48 0.00 -0.40 0.00 0.00 41.96 38.81 1tvv s TYR 261 CO -0.07 -3.51 1.96 -0.39 -1.57 0.00 0.00 175.55 171.97 1tvv h VAL 262 N 3.31 0.53 -0.13 0.71 -1.51 -1.79 0.11 116.25 117.48 1tvv h VAL 262 Ca -0.48 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.99 1tvv h VAL 262 Cb 1.22 0.69 0.00 0.00 -2.13 0.00 0.00 31.29 31.07 1tvv h VAL 262 CO 0.76 0.00 0.00 -0.46 -1.23 0.00 0.00 177.57 176.64 1tvv n ASN 263 N -4.02 0.83 -0.11 4.19 6.94 -1.26 -3.30 115.26 118.53 1tvv n ASN 263 Ca 0.09 -1.83 0.02 0.00 -0.02 0.00 0.00 54.58 52.84 1tvv n ASN 263 Cb 0.62 -0.09 0.00 0.00 -2.36 0.00 0.00 39.78 37.96 1tvv n ASN 263 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 1tvv n HIS 264 N -0.12 0.00 -0.03 -2.53 8.25 0.38 -4.81 115.22 116.36 1tvv n HIS 264 Ca 0.09 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.44 1tvv n HIS 264 Cb 0.16 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.22 1tvv n HIS 264 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1tvv h LEU 265 N 0.54 -1.18 -0.01 2.41 3.38 -1.59 -0.78 115.31 118.08 1tvv h LEU 265 Ca 0.00 0.17 0.03 0.00 0.09 0.00 0.00 57.88 58.17 1tvv h LEU 265 Cb 0.16 0.50 -0.04 0.00 0.09 0.00 0.00 40.66 41.37 1tvv h LEU 265 CO 0.00 -0.38 -0.18 0.44 0.09 0.00 0.00 178.44 178.41 1tvv h ASP 266 N -0.40 -0.53 -0.93 -0.43 3.32 -1.87 -1.45 116.42 114.13 1tvv h ASP 266 Ca 0.11 0.08 0.03 0.00 0.02 0.00 0.00 57.03 57.26 1tvv h ASP 266 Cb 0.58 0.22 -0.05 0.00 0.22 0.00 0.00 39.33 40.30 1tvv h ASP 266 CO -0.43 -0.24 0.61 1.56 -1.72 0.00 0.00 179.24 179.02 1tvv h GLN 267 N -0.29 1.15 -0.22 3.56 7.50 -1.84 0.20 115.11 125.17 1tvv h GLN 267 Ca 0.06 -0.07 -0.16 0.00 0.50 0.00 0.00 58.65 58.98 1tvv h GLN 267 Cb 0.37 -0.26 -0.01 0.00 0.05 0.00 0.00 27.48 27.63 1tvv h GLN 267 CO -0.17 0.76 -0.52 0.97 -1.50 0.00 0.00 178.83 178.36 1tvv h ILE 268 N 1.18 1.31 -0.50 2.54 6.09 -0.93 -2.01 117.51 125.19 1tvv h ILE 268 Ca 0.36 -1.75 -0.03 0.00 -1.37 0.00 0.00 64.86 62.08 1tvv h ILE 268 Cb -0.02 1.70 -0.02 0.00 0.47 0.00 0.00 36.82 38.95 1tvv h ILE 268 CO -0.10 0.55 0.21 0.11 -3.07 0.00 0.00 178.15 175.85 1tvv h LYS 269 N 0.50 0.74 -0.92 2.19 1.57 -0.42 -1.56 116.57 118.67 1tvv h LYS 269 Ca 0.02 -0.13 0.16 0.00 -1.87 0.00 0.00 60.65 58.83 1tvv h LYS 269 Cb 1.08 -0.12 -0.10 0.00 0.08 0.00 0.00 32.23 33.17 1tvv h LYS 269 CO 0.10 0.65 0.51 1.49 -0.57 0.00 0.00 179.45 181.64 1tvv h GLU 270 N 0.67 0.68 -0.01 3.15 4.81 -0.34 0.70 114.58 124.23 1tvv h GLU 270 Ca 0.17 -0.04 -0.14 0.00 -0.13 0.00 0.00 59.36 59.21 1tvv h GLU 270 Cb 0.18 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.39 1tvv h GLU 270 CO -0.02 0.45 -0.66 0.37 -0.73 0.00 0.00 179.01 178.42 1tvv h GLN 271 N 0.70 0.05 0.00 1.92 4.15 -0.61 -2.93 115.11 118.39 1tvv h GLN 271 Ca 0.51 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.89 1tvv h GLN 271 Cb 0.73 0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.43 1tvv h GLN 271 CO -0.37 0.69 0.00 1.28 -1.93 0.00 0.00 178.83 178.50 1tvv n LEU 272 N -3.77 0.00 -1.12 -2.39 4.77 0.23 -2.01 117.00 112.71 1tvv n LEU 272 Ca -0.01 0.17 0.10 0.00 -0.03 0.00 0.00 56.01 56.24 1tvv n LEU 272 Cb 0.65 -0.17 0.27 0.00 -2.33 0.00 0.00 43.42 41.83 1tvv n LEU 272 CO 0.43 -0.09 0.73 -1.54 -1.33 0.00 0.00 177.39 175.59 1tvv n SER 273 N -1.17 3.24 -4.88 -1.43 3.41 -1.10 -4.93 113.62 106.75 1tvv n SER 273 Ca 0.09 -2.01 -0.24 0.00 -0.26 0.00 0.00 58.87 56.45 1tvv n SER 273 Cb 0.09 -0.41 -0.04 0.00 -0.26 0.00 0.00 64.21 63.60 1tvv n SER 273 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1tvv s ARG 274 N -1.21 3.16 -0.35 4.33 3.00 -0.85 -5.10 118.95 121.93 1tvv s ARG 274 Ca 0.40 -0.80 0.02 0.00 0.00 0.00 0.00 55.73 55.35 1tvv s ARG 274 Cb 0.21 -2.77 0.10 0.00 0.00 0.00 0.00 34.95 32.49 1tvv s ARG 274 CO 0.27 0.47 0.07 0.99 0.00 0.00 0.00 175.30 177.10 1tvv s THR 275 N -1.86 2.52 0.19 0.02 2.01 -1.26 -5.08 115.64 112.18 1tvv s THR 275 Ca 0.33 -2.20 -0.30 0.00 0.31 0.00 0.00 61.69 59.84 1tvv s THR 275 Cb -0.10 -2.79 -0.17 0.00 0.01 0.00 0.00 72.50 69.46 1tvv s THR 275 CO 0.26 -0.56 0.69 -0.81 -0.69 0.00 0.00 174.62 173.51 1tvv n PRO 276 N 4.35 0.25 -2.86 4.92 -0.04 -1.26 -4.99 135.00 135.37 1tvv n PRO 276 Ca 0.01 0.09 -0.20 0.00 -0.04 0.00 0.00 63.50 63.35 1tvv n PRO 276 Cb 0.42 -1.23 0.06 0.00 -0.04 0.00 0.00 33.50 32.71 1tvv n PRO 276 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1tvv s ARG 277 N -0.91 2.26 0.37 0.54 0.52 -1.26 -5.04 118.95 115.42 1tvv s ARG 277 Ca 0.67 -1.33 -0.28 0.00 -0.52 0.00 0.00 55.73 54.28 1tvv s ARG 277 Cb -0.94 -2.57 -0.11 0.00 0.52 0.00 0.00 34.95 31.85 1tvv s ARG 277 CO 0.56 -0.89 1.43 -2.30 0.02 0.00 0.00 175.30 174.13 1tvv n PRO 278 N -2.34 2.52 -2.22 3.54 -0.02 -1.26 -4.93 135.00 130.29 1tvv n PRO 278 Ca 0.13 0.88 -0.35 0.00 -2.02 0.00 0.00 63.50 62.14 1tvv n PRO 278 Cb 0.61 -2.57 0.01 0.00 -0.02 0.00 0.00 33.50 31.52 1tvv n PRO 278 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1tvv s ALA 279 N -1.09 2.71 1.23 3.55 0.00 -1.26 -4.81 121.76 122.10 1tvv s ALA 279 Ca 0.54 0.87 -0.18 0.00 0.00 0.00 0.00 51.96 53.19 1tvv s ALA 279 Cb -0.50 -3.38 0.27 0.00 0.00 0.00 0.00 23.12 19.51 1tvv s ALA 279 CO 0.63 -0.81 0.93 -0.35 0.00 0.00 0.00 175.76 176.15 1tvv n PRO 280 N -1.23 -2.95 -4.04 0.00 -0.04 -1.25 -4.76 135.00 120.72 1tvv n PRO 280 Ca 0.11 -1.48 -0.17 0.00 -0.04 0.00 0.00 63.50 61.92 1tvv n PRO 280 Cb 0.50 -1.42 -0.16 0.00 -0.04 0.00 0.00 33.50 32.39 1tvv n PRO 280 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1tvv s THR 281 N -2.65 0.30 0.11 0.52 2.01 0.55 -1.84 115.64 114.64 1tvv s THR 281 Ca 0.61 -0.05 -0.22 0.00 0.31 0.00 0.00 61.69 62.34 1tvv s THR 281 Cb -0.06 -0.33 -0.07 0.00 0.01 0.00 0.00 72.50 72.05 1tvv s THR 281 CO 0.47 0.14 0.66 -0.22 -0.69 0.00 0.00 174.62 174.98 1tvv s LEU 282 N 0.59 4.55 -0.21 4.42 2.96 -1.26 0.28 118.68 130.02 1tvv s LEU 282 Ca -0.06 1.42 -0.01 0.00 -0.22 0.00 0.00 54.13 55.26 1tvv s LEU 282 Cb -0.09 -3.06 0.06 0.00 0.50 0.00 0.00 46.19 43.59 1tvv s LEU 282 CO -0.01 0.24 -0.01 -1.58 -1.32 0.00 0.00 176.35 173.67 1tvv s GLN 283 N -1.09 1.12 0.07 1.98 0.74 0.18 -4.94 119.66 117.72 1tvv s GLN 283 Ca 0.32 -0.67 -0.06 0.00 0.05 0.00 0.00 55.36 55.01 1tvv s GLN 283 Cb -0.21 -2.30 -0.05 0.00 1.10 0.00 0.00 33.01 31.55 1tvv s GLN 283 CO 0.22 -0.60 0.32 -0.51 -0.55 0.00 0.00 175.29 174.17 1tvv s LEU 284 N 1.65 4.33 0.10 3.68 2.01 -1.26 -0.60 118.68 128.59 1tvv s LEU 284 Ca -0.03 0.57 -0.31 0.00 0.01 0.00 0.00 54.13 54.38 1tvv s LEU 284 Cb -0.18 -2.97 -0.10 0.00 0.01 0.00 0.00 46.19 42.95 1tvv s LEU 284 CO -0.07 0.16 1.80 0.21 1.01 0.00 0.00 176.35 179.46 1tvv s ASN 285 N -2.05 6.47 0.38 2.29 3.84 -0.20 -4.88 114.94 120.79 1tvv s ASN 285 Ca 0.34 2.68 0.24 0.00 0.21 0.00 0.00 52.86 56.33 1tvv s ASN 285 Cb -0.13 -2.56 0.53 0.00 -0.55 0.00 0.00 41.25 38.54 1tvv s ASN 285 CO 0.21 -0.98 1.68 -0.65 -2.79 0.00 0.00 177.10 174.56 1tvv h PRO 286 N 8.75 0.00 0.02 0.43 0.11 -1.96 -3.32 132.00 136.03 1tvv h PRO 286 Ca -0.45 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 65.44 1tvv h PRO 286 Cb 1.21 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 1tvv h PRO 286 CO 0.94 0.00 -0.95 -0.44 -0.21 0.00 0.00 178.00 177.35 1tvv h ASP 287 N 0.00 0.30 -3.28 -2.05 3.32 -2.01 -3.45 116.42 109.26 1tvv h ASP 287 Ca 0.00 -0.26 -0.56 0.00 0.02 0.00 0.00 57.03 56.22 1tvv h ASP 287 Cb 0.89 -0.09 -0.04 0.00 0.22 0.00 0.00 39.33 40.31 1tvv h ASP 287 CO 0.00 1.09 -0.15 -0.54 -1.72 0.00 0.00 179.24 177.92 1tvv s LYS 288 N -3.10 3.86 0.00 3.56 1.02 -1.25 -4.98 119.74 118.84 1tvv s LYS 288 Ca -0.03 0.32 0.00 0.00 0.02 0.00 0.00 55.97 56.28 1tvv s LYS 288 Cb 0.09 -2.88 0.00 0.00 -0.52 0.00 0.00 37.83 34.53 1tvv s LYS 288 CO 0.84 0.46 0.00 0.72 -0.92 0.00 0.00 175.35 176.45 1tvv n HIS 289 N 0.57 0.00 -2.72 3.18 8.25 -1.26 -4.90 115.22 118.34 1tvv n HIS 289 Ca -0.04 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.99 1tvv n HIS 289 Cb 0.52 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.60 1tvv n HIS 289 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1tvv s ASP 290 N -1.10 6.23 0.61 0.41 2.15 -1.26 -4.40 116.67 119.30 1tvv s ASP 290 Ca 0.00 -0.57 0.35 0.00 0.43 0.00 0.00 52.55 52.76 1tvv s ASP 290 Cb 0.00 -2.49 1.97 0.00 -0.30 0.00 0.00 42.92 42.11 1tvv s ASP 290 CO 0.00 -1.55 2.26 0.16 -0.17 0.00 0.00 175.17 175.88 1tvv h ILE 291 N 6.02 0.33 0.00 4.11 3.07 -1.93 0.85 117.51 129.96 1tvv h ILE 291 Ca -0.28 -0.09 0.00 0.00 1.55 0.00 0.00 64.86 66.04 1tvv h ILE 291 Cb 1.06 1.07 0.00 0.00 -0.27 0.00 0.00 36.82 38.68 1tvv h ILE 291 CO 1.20 0.02 0.00 -0.26 -1.05 0.00 0.00 178.15 178.06 1tvv h PHE 292 N 0.00 0.00 -0.38 0.16 0.04 -1.88 -2.17 116.94 112.71 1tvv h PHE 292 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1tvv h PHE 292 Cb 0.07 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.22 1tvv h PHE 292 CO 0.00 0.00 0.00 -3.47 -0.60 0.00 0.00 178.31 174.24 1tvv n ASP 293 N -2.98 3.73 -4.80 2.17 -0.08 0.28 -4.81 116.55 110.05 1tvv n ASP 293 Ca 0.00 -2.51 -0.33 0.00 -1.51 0.00 0.00 54.79 50.44 1tvv n ASP 293 Cb 0.28 -0.43 -0.00 0.00 2.34 0.00 0.00 41.12 43.30 1tvv n ASP 293 CO 0.00 0.00 0.00 -0.36 0.12 0.00 0.00 177.20 176.96 1tvv s PHE 294 N -1.93 2.92 0.13 -0.67 0.40 -0.82 -5.01 117.98 113.01 1tvv s PHE 294 Ca 0.37 1.54 0.03 0.00 -0.60 0.00 0.00 56.93 58.26 1tvv s PHE 294 Cb 0.26 -3.07 -0.04 0.00 0.51 0.00 0.00 43.02 40.67 1tvv s PHE 294 CO 0.15 -1.13 -0.06 0.34 0.70 0.00 0.00 175.22 175.22 1tvv s ASP 295 N -2.42 1.34 0.36 1.36 2.15 -1.26 -5.03 116.67 113.17 1tvv s ASP 295 Ca 0.66 -1.05 0.18 0.00 0.43 0.00 0.00 52.55 52.77 1tvv s ASP 295 Cb -0.17 0.07 1.26 0.00 -0.30 0.00 0.00 42.92 43.78 1tvv s ASP 295 CO 0.31 -0.45 1.57 0.23 -0.17 0.00 0.00 175.17 176.65 1tvv n MET 296 N -0.14 -0.06 0.11 4.34 2.81 -1.26 0.17 117.12 123.09 1tvv n MET 296 Ca -0.10 1.38 0.12 0.00 -1.81 0.00 0.00 57.70 57.29 1tvv n MET 296 Cb 0.61 -2.45 0.46 0.00 -0.71 0.00 0.00 33.22 31.14 1tvv n MET 296 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1tvv n LYS 297 N -5.27 0.19 0.00 0.03 5.02 -1.26 -3.00 118.16 113.87 1tvv n LYS 297 Ca 0.36 0.35 0.15 0.00 -2.02 0.00 0.00 58.31 57.14 1tvv n LYS 297 Cb 1.21 -1.82 0.68 0.00 -0.02 0.00 0.00 35.03 35.09 1tvv n LYS 297 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1tvv n ASP 298 N -2.16 0.72 -4.01 4.39 8.00 0.13 -4.75 116.55 118.85 1tvv n ASP 298 Ca 0.03 -1.06 -0.29 0.00 0.71 0.00 0.00 54.79 54.18 1tvv n ASP 298 Cb 0.28 -0.02 -0.17 0.00 -0.02 0.00 0.00 41.12 41.19 1tvv n ASP 298 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1tvv s ILE 299 N -2.15 1.44 -0.07 0.53 1.01 -1.16 -1.03 121.20 119.78 1tvv s ILE 299 Ca 0.38 -0.57 0.02 0.00 0.00 0.00 0.00 60.65 60.48 1tvv s ILE 299 Cb 0.21 -1.35 0.01 0.00 0.01 0.00 0.00 42.46 41.34 1tvv s ILE 299 CO 0.39 0.43 -0.13 -0.75 0.00 0.00 0.00 174.94 174.88 1tvv s LYS 300 N 1.33 1.80 -0.30 2.79 2.20 0.24 -4.99 119.74 122.80 1tvv s LYS 300 Ca 0.00 -0.45 -0.10 0.00 -0.36 0.00 0.00 55.97 55.06 1tvv s LYS 300 Cb -0.14 -1.47 -0.02 0.00 -1.51 0.00 0.00 37.83 34.69 1tvv s LYS 300 CO -0.07 0.05 0.17 -1.17 -0.36 0.00 0.00 175.35 173.96 1tvv s LEU 301 N 0.61 4.09 0.03 5.43 0.20 -1.26 0.48 118.68 128.27 1tvv s LEU 301 Ca -0.14 -0.38 0.02 0.00 0.69 0.00 0.00 54.13 54.31 1tvv s LEU 301 Cb -0.16 -2.04 -0.04 0.00 -0.43 0.00 0.00 46.19 43.53 1tvv s LEU 301 CO 0.04 -0.16 0.05 -0.76 -0.29 0.00 0.00 176.35 175.23 1tvv s LEU 302 N 1.66 3.73 -1.10 -0.68 1.43 0.14 -4.65 118.68 119.21 1tvv s LEU 302 Ca 0.05 0.02 -0.05 0.00 -1.03 0.00 0.00 54.13 53.13 1tvv s LEU 302 Cb -0.17 -2.27 0.01 0.00 0.03 0.00 0.00 46.19 43.79 1tvv s LEU 302 CO 0.07 0.23 0.94 0.59 0.23 0.00 0.00 176.35 178.42 1tvv n ASN 303 N 0.93 -4.29 -4.40 2.29 3.02 -1.26 -0.33 115.26 111.22 1tvv n ASN 303 Ca -0.12 -0.48 -0.45 0.00 -0.03 0.00 0.00 54.58 53.50 1tvv n ASN 303 Cb 0.52 -4.37 -0.03 0.00 -0.61 0.00 0.00 39.78 35.29 1tvv n ASN 303 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1tvv s TYR 304 N -3.28 3.14 -0.72 3.10 5.04 -1.26 -4.07 117.35 119.29 1tvv s TYR 304 Ca 0.30 -1.25 -0.02 0.00 -2.44 0.00 0.00 57.07 53.67 1tvv s TYR 304 Cb -0.13 -4.10 0.18 0.00 0.35 0.00 0.00 41.96 38.25 1tvv s TYR 304 CO 0.62 -1.35 0.56 0.34 -1.34 0.00 0.00 175.55 174.38 1tvv s ASP 305 N 3.38 5.45 0.60 4.32 2.15 -1.26 -5.08 116.67 126.22 1tvv s ASP 305 Ca 0.21 -3.22 0.06 0.00 0.43 0.00 0.00 52.55 50.03 1tvv s ASP 305 Cb -0.14 -1.86 0.09 0.00 -0.30 0.00 0.00 42.92 40.71 1tvv s ASP 305 CO -0.01 -0.29 0.83 -2.16 -0.17 0.00 0.00 175.17 173.37 1tvv s PRO 306 N -0.60 2.17 0.57 4.34 0.04 -1.26 -4.86 135.00 135.41 1tvv s PRO 306 Ca 0.21 -1.44 -0.05 0.00 0.04 0.00 0.00 61.00 59.75 1tvv s PRO 306 Cb -0.15 -2.56 0.00 0.00 0.04 0.00 0.00 34.50 31.83 1tvv s PRO 306 CO -0.07 -0.98 0.88 0.71 0.04 0.00 0.00 177.00 177.58 1tvv s TYR 307 N -2.78 3.28 1.07 0.56 1.51 0.24 -4.93 117.35 116.30 1tvv s TYR 307 Ca 0.62 0.64 -0.13 0.00 -1.01 0.00 0.00 57.07 57.19 1tvv s TYR 307 Cb -0.06 -2.67 0.18 0.00 -0.11 0.00 0.00 41.96 39.30 1tvv s TYR 307 CO 0.40 -0.74 0.75 -0.35 -1.11 0.00 0.00 175.55 174.49 1tvv n PRO 308 N -2.53 -1.46 -2.64 -1.71 -0.04 -1.26 -2.33 135.00 123.03 1tvv n PRO 308 Ca 0.04 -0.39 -0.41 0.00 -0.04 0.00 0.00 63.50 62.70 1tvv n PRO 308 Cb 0.57 -2.08 -0.04 0.00 -0.04 0.00 0.00 33.50 31.92 1tvv n PRO 308 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1tvv s ALA 309 N -2.43 3.28 -0.26 0.55 0.00 -1.26 -3.31 121.76 118.33 1tvv s ALA 309 Ca 0.64 0.66 -0.16 0.00 0.00 0.00 0.00 51.96 53.10 1tvv s ALA 309 Cb -0.21 -3.32 -0.03 0.00 0.00 0.00 0.00 23.12 19.55 1tvv s ALA 309 CO 0.64 -0.15 0.44 0.42 0.00 0.00 0.00 175.76 177.11 1tvv s ILE 310 N 0.19 5.13 -0.04 0.00 1.01 -1.26 -4.95 121.20 121.28 1tvv s ILE 310 Ca 0.50 0.71 -0.25 0.00 0.00 0.00 0.00 60.65 61.60 1tvv s ILE 310 Cb -0.25 -3.76 -0.04 0.00 0.01 0.00 0.00 42.46 38.43 1tvv s ILE 310 CO 0.31 0.13 0.77 -0.75 0.00 0.00 0.00 174.94 175.39 1tvv s LYS 311 N 2.16 4.47 -0.09 2.79 2.36 -1.26 -5.06 119.74 125.11 1tvv s LYS 311 Ca 0.18 1.02 -0.08 0.00 -2.55 0.00 0.00 55.97 54.54 1tvv s LYS 311 Cb -0.16 -3.44 0.02 0.00 -1.05 0.00 0.00 37.83 33.21 1tvv s LYS 311 CO 0.10 0.06 0.24 0.00 1.55 0.00 0.00 175.35 177.29 1tvv s ALA 312 N 0.76 -0.58 0.32 3.13 0.00 -1.26 -4.97 121.76 119.15 1tvv s ALA 312 Ca 0.41 0.67 -0.29 0.00 0.00 0.00 0.00 51.96 52.75 1tvv s ALA 312 Cb -0.19 -0.39 -0.10 0.00 0.00 0.00 0.00 23.12 22.44 1tvv s ALA 312 CO 0.21 -0.11 1.24 -1.25 0.00 0.00 0.00 175.76 175.85 1tvv s PRO 313 N 0.16 4.42 -0.50 0.00 0.04 -1.26 -5.01 135.00 132.85 1tvv s PRO 313 Ca -0.00 2.08 -0.28 0.00 0.04 0.00 0.00 61.00 62.84 1tvv s PRO 313 Cb -0.02 -3.09 0.02 0.00 0.04 0.00 0.00 34.50 31.45 1tvv s PRO 313 CO 0.00 -0.08 1.31 0.14 0.04 0.00 0.00 177.00 178.41 1tvv s VAL 314 N -1.16 3.96 -1.43 -0.36 -7.23 -1.26 -4.93 120.40 107.99 1tvv s VAL 314 Ca 0.48 0.91 -0.08 0.00 -1.81 0.00 0.00 61.98 61.48 1tvv s VAL 314 Cb -0.37 -4.47 0.05 0.00 0.56 0.00 0.00 36.38 32.15 1tvv s VAL 314 CO 0.49 -1.05 2.51 0.00 -0.31 0.00 0.00 175.10 176.74 1tvv n ALA 315 N 8.75 6.82 -0.26 1.32 0.00 -1.26 -5.04 120.51 130.84 1tvv n ALA 315 Ca 0.13 -3.91 0.00 0.00 0.00 0.00 0.00 53.44 49.66 1tvv n ALA 315 Cb 0.49 -3.05 0.00 0.00 0.00 0.00 0.00 19.45 16.89 1tvv n ALA 315 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78