#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tv4 s PHE 3 N 0.00 3.51 0.02 1.09 -0.12 -1.26 -5.02 117.98 116.20 1tv4 s PHE 3 Ca 0.00 0.75 -0.27 0.00 -0.05 0.00 0.00 56.93 57.36 1tv4 s PHE 3 Cb 0.00 -2.22 -0.16 0.00 -0.63 0.00 0.00 43.02 40.01 1tv4 s PHE 3 CO 0.00 -0.06 1.23 0.00 -0.05 0.00 0.00 175.22 176.34 1tv4 h ARG 4 N 0.92 -0.72 -3.32 1.99 2.47 -2.04 -3.47 114.38 110.21 1tv4 h ARG 4 Ca -0.48 0.05 -0.06 0.00 -1.26 0.00 0.00 59.98 58.23 1tv4 h ARG 4 Cb 1.20 0.16 -0.14 0.00 -1.65 0.00 0.00 29.97 29.54 1tv4 h ARG 4 CO 0.63 -0.41 -0.09 -1.59 0.56 0.00 0.00 179.97 179.06 1tv4 s LYS 5 N -4.87 1.02 0.26 0.04 -2.85 -1.26 -5.12 119.74 106.96 1tv4 s LYS 5 Ca -0.15 -0.63 -0.31 0.00 -1.00 0.00 0.00 55.97 53.88 1tv4 s LYS 5 Cb 0.02 0.45 -0.12 0.00 -2.06 0.00 0.00 37.83 36.11 1tv4 s LYS 5 CO 0.50 -0.38 1.54 0.43 0.10 0.00 0.00 175.35 177.53 1tv4 n SER 6 N -0.03 3.44 -4.76 0.03 7.64 -1.26 -4.89 113.62 113.79 1tv4 n SER 6 Ca -0.17 1.13 -0.41 0.00 1.01 0.00 0.00 58.87 60.44 1tv4 n SER 6 Cb 0.63 -1.52 -0.03 0.00 -1.01 0.00 0.00 64.21 62.27 1tv4 n SER 6 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 1tv4 s PHE 7 N 0.14 3.23 0.32 1.43 5.36 -1.26 -5.02 117.98 122.17 1tv4 s PHE 7 Ca 0.67 1.42 0.01 0.00 -0.96 0.00 0.00 56.93 58.07 1tv4 s PHE 7 Cb -0.56 -3.57 -0.01 0.00 -0.34 0.00 0.00 43.02 38.54 1tv4 s PHE 7 CO 0.47 -1.57 0.37 0.16 -1.46 0.00 0.00 175.22 173.19 1tv4 s ASP 8 N -0.34 1.04 0.55 6.13 1.47 -1.26 -4.83 116.67 119.43 1tv4 s ASP 8 Ca 0.50 -1.54 0.25 0.00 1.18 0.00 0.00 52.55 52.94 1tv4 s ASP 8 Cb -0.37 0.59 1.46 0.00 -0.34 0.00 0.00 42.92 44.26 1tv4 s ASP 8 CO 0.46 -1.15 2.06 0.00 0.68 0.00 0.00 175.17 177.21 1tv4 h TYR 10 N 0.00 0.76 -0.54 0.00 -1.99 -1.92 -1.94 116.97 111.33 1tv4 h TYR 10 Ca 0.14 -0.24 -0.04 0.00 2.00 0.00 0.00 58.73 60.59 1tv4 h TYR 10 Cb 0.64 -0.15 -0.03 0.00 2.00 0.00 0.00 36.73 39.19 1tv4 h TYR 10 CO 0.00 0.97 0.16 -0.44 -0.00 0.00 0.00 178.16 178.86 1tv4 h ASP 11 N 0.33 0.75 -0.27 3.88 3.32 -1.68 -1.81 116.42 120.94 1tv4 h ASP 11 Ca 0.03 -0.12 -0.00 0.00 0.02 0.00 0.00 57.03 56.96 1tv4 h ASP 11 Cb 0.87 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.22 1tv4 h ASP 11 CO 0.07 0.72 0.16 0.15 -1.72 0.00 0.00 179.24 178.62 1tv4 h PHE 12 N 0.79 0.37 -0.20 4.55 3.57 -1.12 -0.86 116.94 124.03 1tv4 h PHE 12 Ca 0.18 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.69 1tv4 h PHE 12 Cb 0.24 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.84 1tv4 h PHE 12 CO 0.01 0.30 0.08 -0.92 -2.23 0.00 0.00 178.31 175.55 1tv4 h TYR 13 N 0.34 0.15 -0.30 0.41 3.20 -0.98 0.12 116.97 119.90 1tv4 h TYR 13 Ca 0.10 0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.04 1tv4 h TYR 13 Cb 0.04 -0.04 -0.06 0.00 1.54 0.00 0.00 36.73 38.22 1tv4 h TYR 13 CO -0.04 0.08 -0.06 -0.44 -1.64 0.00 0.00 178.16 176.06 1tv4 h ASP 14 N 0.18 -0.25 0.04 -2.11 3.45 -1.07 -2.49 116.42 114.17 1tv4 h ASP 14 Ca 0.09 0.09 -0.12 0.00 0.43 0.00 0.00 57.03 57.51 1tv4 h ASP 14 Cb 0.04 0.17 -0.01 0.00 -0.56 0.00 0.00 39.33 38.98 1tv4 h ASP 14 CO -0.08 -0.09 -0.40 0.03 -1.57 0.00 0.00 179.24 177.13 1tv4 h ARG 15 N 0.02 0.46 0.00 3.56 3.08 -0.88 -2.98 114.38 117.64 1tv4 h ARG 15 Ca 0.15 -0.23 0.00 0.00 0.07 0.00 0.00 59.98 59.97 1tv4 h ARG 15 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.27 1tv4 h ARG 15 CO -0.30 0.79 0.00 0.00 -1.07 0.00 0.00 179.97 179.39 1tv4 h ALA 16 N 1.19 1.00 0.00 0.04 0.00 -0.33 0.16 119.26 121.32 1tv4 h ALA 16 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1tv4 h ALA 16 Cb 0.87 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1tv4 h ALA 16 CO 0.07 0.00 -0.61 0.87 0.00 0.00 0.00 179.25 179.58 1tv4 h LYS 17 N 0.00 0.00 0.00 0.00 1.57 -1.33 -3.38 116.57 113.43 1tv4 h LYS 17 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1tv4 h LYS 17 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.51 1tv4 h LYS 17 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 179.45 180.21 1tv4 n VAL 18 N -2.39 0.42 -1.08 0.50 0.24 -0.84 -5.09 118.33 110.08 1tv4 n VAL 18 Ca 0.03 -0.46 -0.30 0.00 -2.04 0.00 0.00 64.34 61.57 1tv4 n VAL 18 Cb 0.48 0.87 0.22 0.00 -1.47 0.00 0.00 33.84 33.94 1tv4 n VAL 18 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1tv4 s GLY 19 N -0.42 1.57 0.06 7.63 0.00 0.50 -4.91 107.32 111.75 1tv4 s GLY 19 Ca 0.00 -0.75 -0.33 0.00 0.00 0.00 0.00 44.72 43.64 1tv4 s GLY 19 CO 0.00 0.05 1.80 -2.21 0.00 0.00 0.00 173.10 172.74 1tv4 n GLU 20 N -4.61 2.46 -2.12 2.90 2.13 -1.23 -4.49 120.64 115.67 1tv4 n GLU 20 Ca 0.10 0.89 -0.38 0.00 0.66 0.00 0.00 57.16 58.43 1tv4 n GLU 20 Cb 0.59 -2.75 -0.00 0.00 0.27 0.00 0.00 31.44 29.55 1tv4 n GLU 20 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1tv4 s LYS 21 N 2.82 3.83 -0.28 5.31 1.02 -1.26 -1.22 119.74 129.96 1tv4 s LYS 21 Ca 0.85 2.00 -0.25 0.00 0.02 0.00 0.00 55.97 58.59 1tv4 s LYS 21 Cb -0.59 -2.59 0.12 0.00 -0.52 0.00 0.00 37.83 34.25 1tv4 s LYS 21 CO 0.42 -0.56 1.03 0.00 -0.92 0.00 0.00 175.35 175.32 1tv4 s THR 23 N 0.18 4.56 0.38 0.00 -4.23 -1.26 -4.51 115.64 110.76 1tv4 s THR 23 Ca 0.03 1.03 0.14 0.00 -1.18 0.00 0.00 61.69 61.72 1tv4 s THR 23 Cb -0.05 -3.76 0.13 0.00 1.34 0.00 0.00 72.50 70.17 1tv4 s THR 23 CO -0.06 -0.89 1.88 -0.61 -0.54 0.00 0.00 174.62 174.41 1tv4 h GLN 24 N 0.30 0.00 -0.30 3.99 4.15 -1.99 -2.34 115.11 118.92 1tv4 h GLN 24 Ca -0.45 0.00 -0.16 0.00 0.77 0.00 0.00 58.65 58.80 1tv4 h GLN 24 Cb 1.19 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.87 1tv4 h GLN 24 CO 0.61 0.31 -0.46 -0.44 -1.93 0.00 0.00 178.83 176.93 1tv4 h ASP 25 N 0.00 0.86 -0.45 -0.69 3.32 -1.98 0.48 116.42 117.95 1tv4 h ASP 25 Ca -0.00 -0.42 -0.01 0.00 0.02 0.00 0.00 57.03 56.62 1tv4 h ASP 25 Cb 0.57 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.85 1tv4 h ASP 25 CO 0.04 1.18 0.27 0.44 -1.72 0.00 0.00 179.24 179.45 1tv4 h ASP 26 N 0.63 0.57 0.20 6.45 3.32 -1.82 0.17 116.42 125.94 1tv4 h ASP 26 Ca 0.04 -0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 1tv4 h ASP 26 Cb 1.03 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.44 1tv4 h ASP 26 CO 0.10 0.45 -0.10 -0.25 -1.72 0.00 0.00 179.24 177.73 1tv4 h TRP 27 N 0.65 -0.25 -0.36 4.55 2.91 -1.03 0.14 115.95 122.56 1tv4 h TRP 27 Ca 0.17 -0.01 -0.16 0.00 1.13 0.00 0.00 58.89 60.03 1tv4 h TRP 27 Cb 0.00 0.08 -0.01 0.00 -0.51 0.00 0.00 29.16 28.73 1tv4 h TRP 27 CO 0.00 0.13 -0.38 -0.44 -1.03 0.00 0.00 178.44 176.72 1tv4 h ASP 28 N -0.93 0.97 0.07 2.65 3.32 -0.81 -1.66 116.42 120.03 1tv4 h ASP 28 Ca -0.03 -0.47 0.00 0.00 0.02 0.00 0.00 57.03 56.55 1tv4 h ASP 28 Cb 0.49 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.76 1tv4 h ASP 28 CO 0.05 1.24 -0.29 0.18 -1.72 0.00 0.00 179.24 178.69 1tv4 n LEU 29 N -4.09 1.72 0.02 1.55 4.77 0.59 -4.38 117.00 117.18 1tv4 n LEU 29 Ca -0.03 -0.58 0.00 0.00 -0.03 0.00 0.00 56.01 55.38 1tv4 n LEU 29 Cb 0.54 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 1tv4 n LEU 29 CO 0.48 0.31 0.00 0.80 -1.33 0.00 0.00 177.39 177.65 1tv4 n MET 30 N -0.08 0.00 -0.02 3.23 1.56 -1.03 -4.84 117.12 115.94 1tv4 n MET 30 Ca 0.12 0.00 -0.09 0.00 -0.27 0.00 0.00 57.70 57.46 1tv4 n MET 30 Cb 0.43 -0.01 -0.02 0.00 2.15 0.00 0.00 33.22 35.77 1tv4 n MET 30 CO 0.00 0.00 0.00 0.87 -0.73 0.00 0.00 175.97 176.11 1tv4 h LYS 31 N 0.00 -0.25 0.41 2.12 1.57 -0.96 0.16 116.57 119.61 1tv4 h LYS 31 Ca 0.00 0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 1tv4 h LYS 31 Cb 0.00 0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1tv4 h LYS 31 CO 0.00 -0.17 -0.20 0.82 -0.57 0.00 0.00 179.45 179.34 1tv4 h ILE 32 N -0.26 0.52 -0.55 1.86 1.08 -1.55 -2.39 117.51 116.21 1tv4 h ILE 32 Ca 0.12 -0.50 0.02 0.00 -0.39 0.00 0.00 64.86 64.11 1tv4 h ILE 32 Cb 0.44 0.73 -0.03 0.00 -3.07 0.00 0.00 36.82 34.89 1tv4 h ILE 32 CO -0.34 0.08 0.37 1.55 -0.69 0.00 0.00 178.15 179.12 1tv4 h PRO 33 N -0.87 0.67 -0.23 2.37 0.13 -1.59 -1.43 132.00 131.04 1tv4 h PRO 33 Ca -0.06 -0.04 -0.03 0.00 -0.87 0.00 0.00 66.00 65.00 1tv4 h PRO 33 Cb 0.55 -0.15 -0.01 0.00 0.13 0.00 0.00 31.00 31.52 1tv4 h PRO 33 CO 0.09 0.44 0.01 0.52 -0.23 0.00 0.00 178.00 178.83 1tv4 h MET 34 N 0.69 0.40 -0.62 0.86 2.86 -0.98 -1.32 114.93 116.82 1tv4 h MET 34 Ca 0.21 -0.12 -0.08 0.00 -2.06 0.00 0.00 59.70 57.66 1tv4 h MET 34 Cb 0.01 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.61 1tv4 h MET 34 CO -0.05 0.57 0.09 -0.22 1.06 0.00 0.00 176.91 178.35 1tv4 h LYS 35 N 0.18 1.04 -0.57 1.72 1.63 -1.10 0.15 116.57 119.61 1tv4 h LYS 35 Ca 0.07 -0.28 -0.04 0.00 -0.85 0.00 0.00 60.65 59.54 1tv4 h LYS 35 Cb 0.38 -0.12 -0.02 0.00 -0.60 0.00 0.00 32.23 31.87 1tv4 h LYS 35 CO 0.01 0.97 0.20 0.00 -3.45 0.00 0.00 179.45 177.18 1tv4 h ALA 36 N 1.02 0.74 -0.31 5.00 0.00 -1.22 0.56 119.26 125.05 1tv4 h ALA 36 Ca 0.19 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1tv4 h ALA 36 Cb 0.45 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1tv4 h ALA 36 CO 0.01 0.38 0.07 1.98 0.00 0.00 0.00 179.25 181.69 1tv4 h MET 37 N 0.79 0.51 0.07 0.00 1.85 -1.01 -1.29 114.93 115.84 1tv4 h MET 37 Ca 0.19 -0.13 -0.00 0.00 -0.61 0.00 0.00 59.70 59.15 1tv4 h MET 37 Cb 0.24 -0.06 0.00 0.00 0.43 0.00 0.00 31.60 32.21 1tv4 h MET 37 CO -0.01 0.58 -0.03 1.49 -0.40 0.00 0.00 176.91 178.54 1tv4 h GLU 38 N 0.35 -0.08 -0.17 0.39 4.81 -0.43 -2.77 114.58 116.68 1tv4 h GLU 38 Ca 0.10 0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.24 1tv4 h GLU 38 Cb 0.31 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 1tv4 h GLU 38 CO 0.00 -0.05 -0.31 -0.07 -0.73 0.00 0.00 179.01 177.85 1tv4 h LEU 39 N -0.09 0.34 -0.37 1.64 3.38 -0.87 0.05 115.31 119.40 1tv4 h LEU 39 Ca -0.01 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 1tv4 h LEU 39 Cb 0.07 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1tv4 h LEU 39 CO 0.01 0.64 0.21 0.50 0.09 0.00 0.00 178.44 179.90 1tv4 h LYS 40 N 0.30 0.50 -0.12 1.13 3.64 -1.12 -1.46 116.57 119.44 1tv4 h LYS 40 Ca 0.04 -0.05 -0.16 0.00 -1.27 0.00 0.00 60.65 59.21 1tv4 h LYS 40 Cb 0.69 -0.10 0.01 0.00 -0.41 0.00 0.00 32.23 32.42 1tv4 h LYS 40 CO 0.05 0.40 -0.54 0.37 -2.27 0.00 0.00 179.45 177.45 1tv4 h GLN 41 N 0.47 0.58 -0.71 1.90 5.75 -1.36 -0.39 115.11 121.35 1tv4 h GLN 41 Ca 0.13 -0.46 0.12 0.00 -0.15 0.00 0.00 58.65 58.28 1tv4 h GLN 41 Cb 0.03 0.09 -0.08 0.00 1.07 0.00 0.00 27.48 28.59 1tv4 h GLN 41 CO -0.02 1.09 0.30 -0.22 -2.65 0.00 0.00 178.83 177.33 1tv4 h LYS 42 N 0.21 0.47 -0.06 1.69 3.64 -0.85 -1.15 116.57 120.53 1tv4 h LYS 42 Ca -0.03 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1tv4 h LYS 42 Cb 1.18 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.90 1tv4 h LYS 42 CO 0.11 0.31 0.00 0.66 -2.27 0.00 0.00 179.45 178.27 1tv4 n TYR 43 N -4.96 0.05 -3.76 1.91 4.02 -0.56 -4.97 117.16 108.89 1tv4 n TYR 43 Ca 0.12 -0.02 -0.26 0.00 -0.01 0.00 0.00 57.90 57.73 1tv4 n TYR 43 Cb 0.34 0.00 0.05 0.00 -0.02 0.00 0.00 39.34 39.71 1tv4 n TYR 43 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1tv4 n GLY 44 N 1.28 -0.46 3.72 2.72 0.00 -0.30 -4.90 105.19 107.24 1tv4 n GLY 44 Ca 0.16 0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.96 1tv4 n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tv4 s LEU 45 N -7.12 4.38 -0.27 0.99 1.43 -0.36 -4.99 118.68 112.75 1tv4 s LEU 45 Ca 0.48 2.43 -0.02 0.00 -1.03 0.00 0.00 54.13 55.98 1tv4 s LEU 45 Cb -0.23 -3.59 0.16 0.00 0.03 0.00 0.00 46.19 42.55 1tv4 s LEU 45 CO 0.79 -0.69 0.47 -0.62 0.23 0.00 0.00 176.35 176.54 1tv4 s ASP 46 N 0.99 -0.43 0.00 2.29 -1.08 -1.26 -4.93 116.67 112.24 1tv4 s ASP 46 Ca 0.65 0.51 0.28 0.00 -0.52 0.00 0.00 52.55 53.47 1tv4 s ASP 46 Cb -0.39 1.55 1.29 0.00 -1.46 0.00 0.00 42.92 43.92 1tv4 s ASP 46 CO 0.32 -0.28 1.93 0.49 0.52 0.00 0.00 175.17 178.15 1tv4 n PHE 47 N 5.39 0.00 -4.00 -5.34 3.72 -1.26 -4.93 117.46 111.05 1tv4 n PHE 47 Ca -0.03 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.05 1tv4 n PHE 47 Cb 0.50 -0.42 -0.02 0.00 -0.94 0.00 0.00 39.48 38.61 1tv4 n PHE 47 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1tv4 n LYS 48 N -1.42 -3.30 -0.89 -1.08 5.02 -1.26 -1.31 118.16 113.92 1tv4 n LYS 48 Ca 0.09 0.39 0.00 0.00 -2.02 0.00 0.00 58.31 56.78 1tv4 n LYS 48 Cb 0.29 -5.13 0.00 0.00 -0.02 0.00 0.00 35.03 30.17 1tv4 n LYS 48 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1tv4 n GLY 49 N -1.33 0.65 3.77 0.72 0.00 -1.26 -5.01 105.19 102.74 1tv4 n GLY 49 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 1tv4 n GLY 49 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1tv4 s GLU 50 N -0.33 4.62 -0.07 1.61 2.02 -0.43 -4.97 118.70 121.15 1tv4 s GLU 50 Ca 0.00 1.43 -0.15 0.00 0.02 0.00 0.00 54.97 56.27 1tv4 s GLU 50 Cb 0.00 -2.93 -0.30 0.00 0.10 0.00 0.00 34.13 31.00 1tv4 s GLU 50 CO 0.00 0.29 0.68 0.74 0.02 0.00 0.00 175.26 176.99 1tv4 h PHE 51 N 3.41 0.59 -3.16 1.61 -1.00 -1.91 -3.45 116.94 113.03 1tv4 h PHE 51 Ca -0.46 -0.43 -0.57 0.00 2.81 0.00 0.00 57.97 59.32 1tv4 h PHE 51 Cb 1.20 -0.02 -0.36 0.00 3.61 0.00 0.00 35.95 40.37 1tv4 h PHE 51 CO 0.61 1.56 -0.82 0.42 -1.61 0.00 0.00 178.31 178.46 1tv4 s ILE 52 N -2.51 1.33 0.57 -0.55 1.01 -1.26 -3.49 121.20 116.29 1tv4 s ILE 52 Ca -0.17 -0.48 -0.18 0.00 0.00 0.00 0.00 60.65 59.82 1tv4 s ILE 52 Cb 0.04 -1.28 -0.05 0.00 0.01 0.00 0.00 42.46 41.19 1tv4 s ILE 52 CO 0.82 0.42 1.09 -2.16 0.00 0.00 0.00 174.94 175.10 1tv4 s PRO 53 N 1.53 3.33 0.00 2.79 0.04 -1.26 -4.96 135.00 136.47 1tv4 s PRO 53 Ca 0.04 1.42 0.00 0.00 0.04 0.00 0.00 61.00 62.50 1tv4 s PRO 53 Cb -0.13 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.39 1tv4 s PRO 53 CO -0.09 -0.83 0.00 0.25 0.04 0.00 0.00 177.00 176.37 1tv4 n THR 54 N -1.62 0.00 -2.36 1.26 -2.24 -1.26 -4.99 114.28 103.07 1tv4 n THR 54 Ca 0.10 -0.08 -0.40 0.00 -2.27 0.00 0.00 64.05 61.40 1tv4 n THR 54 Cb 0.52 0.48 -0.03 0.00 -2.10 0.00 0.00 70.33 69.20 1tv4 n THR 54 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1tv4 s ASP 55 N -0.90 5.84 0.42 3.42 -1.08 -1.26 -4.87 116.67 118.25 1tv4 s ASP 55 Ca 0.00 -0.18 0.08 0.00 -0.52 0.00 0.00 52.55 51.93 1tv4 s ASP 55 Cb 0.00 -2.55 0.90 0.00 -1.46 0.00 0.00 42.92 39.81 1tv4 s ASP 55 CO 0.00 -2.04 2.05 0.11 0.52 0.00 0.00 175.17 175.82 1tv4 h LYS 56 N 11.81 0.45 -0.16 4.34 1.79 -1.98 -1.58 116.57 131.22 1tv4 h LYS 56 Ca -0.27 -0.03 -0.01 0.00 -2.18 0.00 0.00 60.65 58.16 1tv4 h LYS 56 Cb 1.09 -0.10 -0.01 0.00 -1.58 0.00 0.00 32.23 31.64 1tv4 h LYS 56 CO 1.26 0.32 0.05 0.22 -1.08 0.00 0.00 179.45 180.22 1tv4 h ASP 57 N 0.46 0.23 -0.17 0.86 3.58 -1.99 0.23 116.42 119.61 1tv4 h ASP 57 Ca 0.12 -0.19 -0.09 0.00 0.42 0.00 0.00 57.03 57.29 1tv4 h ASP 57 Cb -0.01 -0.06 -0.02 0.00 1.72 0.00 0.00 39.33 40.96 1tv4 h ASP 57 CO -0.02 0.37 -0.17 -0.03 -2.88 0.00 0.00 179.24 176.50 1tv4 h MET 58 N 0.09 0.58 -0.48 0.28 4.05 -1.88 -1.89 114.93 115.68 1tv4 h MET 58 Ca 0.05 -0.20 -0.12 0.00 -0.28 0.00 0.00 59.70 59.16 1tv4 h MET 58 Cb 0.21 -0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 30.95 1tv4 h MET 58 CO -0.00 0.73 -0.15 0.52 0.23 0.00 0.00 176.91 178.23 1tv4 h MET 59 N 0.53 0.95 -0.72 0.39 2.86 -1.10 -1.10 114.93 116.74 1tv4 h MET 59 Ca 0.09 -0.38 -0.05 0.00 -2.06 0.00 0.00 59.70 57.29 1tv4 h MET 59 Cb 0.59 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 32.18 1tv4 h MET 59 CO 0.04 1.05 0.24 1.49 1.06 0.00 0.00 176.91 180.79 1tv4 h GLU 60 N 0.81 1.09 -0.58 1.72 4.81 -0.65 -0.37 114.58 121.41 1tv4 h GLU 60 Ca 0.12 -0.22 -0.09 0.00 -0.13 0.00 0.00 59.36 59.04 1tv4 h GLU 60 Cb 0.72 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.91 1tv4 h GLU 60 CO 0.05 0.92 0.01 0.87 -0.73 0.00 0.00 179.01 180.14 1tv4 h LYS 61 N 1.06 1.01 -0.60 1.92 1.57 -1.10 -1.12 116.57 119.31 1tv4 h LYS 61 Ca 0.23 -0.30 -0.07 0.00 -1.87 0.00 0.00 60.65 58.64 1tv4 h LYS 61 Cb 0.27 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.46 1tv4 h LYS 61 CO -0.01 0.98 0.11 1.25 -0.57 0.00 0.00 179.45 181.21 1tv4 h LEU 62 N 0.92 0.94 -0.28 2.94 5.85 -0.66 -0.34 115.31 124.69 1tv4 h LEU 62 Ca 0.17 -0.26 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 1tv4 h LEU 62 Cb 0.52 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 1tv4 h LEU 62 CO 0.03 0.96 0.12 0.15 -0.34 0.00 0.00 178.44 179.35 1tv4 h PHE 63 N 0.89 0.41 -0.69 1.25 3.57 -0.80 -0.36 116.94 121.21 1tv4 h PHE 63 Ca 0.18 -0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.64 1tv4 h PHE 63 Cb 0.41 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 38.99 1tv4 h PHE 63 CO 0.03 0.40 0.38 0.87 -2.23 0.00 0.00 178.31 177.76 1tv4 h LYS 64 N 0.30 0.95 -0.26 1.11 1.57 -1.03 -0.66 116.57 118.56 1tv4 h LYS 64 Ca 0.09 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.74 1tv4 h LYS 64 Cb 0.15 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 1tv4 h LYS 64 CO -0.01 0.70 0.05 0.00 -0.57 0.00 0.00 179.45 179.62 1tv4 h ALA 65 N 1.45 0.35 -0.55 3.86 0.00 -0.64 0.40 119.26 124.13 1tv4 h ALA 65 Ca 0.25 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 1tv4 h ALA 65 Cb 0.02 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1tv4 h ALA 65 CO -0.04 0.03 0.23 0.78 0.00 0.00 0.00 179.25 180.25 1tv4 h GLY 66 N 0.25 0.88 0.93 0.00 0.00 -0.70 0.01 103.07 104.44 1tv4 h GLY 66 Ca 0.08 -0.47 -0.00 0.00 0.00 0.00 0.00 47.33 46.94 1tv4 h GLY 66 CO 0.00 0.44 -0.02 -2.75 0.00 0.00 0.00 176.54 174.22 1tv4 h PHE 67 N 0.75 -0.04 -0.37 5.60 3.57 -1.02 -2.26 116.94 123.17 1tv4 h PHE 67 Ca 0.19 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.67 1tv4 h PHE 67 Cb 0.18 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 38.92 1tv4 h PHE 67 CO 0.01 0.04 0.18 1.49 -2.23 0.00 0.00 178.31 177.80 1tv4 h GLU 68 N -0.12 0.51 -0.16 1.11 4.81 -0.74 -1.00 114.58 118.99 1tv4 h GLU 68 Ca -0.00 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.15 1tv4 h GLU 68 Cb 0.11 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 1tv4 h GLU 68 CO 0.01 0.40 0.01 1.98 -0.73 0.00 0.00 179.01 180.67 1tv4 h MET 69 N 0.52 0.28 -0.63 1.92 4.05 -0.74 0.67 114.93 120.98 1tv4 h MET 69 Ca 0.13 -0.08 -0.01 0.00 -0.28 0.00 0.00 59.70 59.46 1tv4 h MET 69 Cb 0.05 -0.03 -0.03 0.00 -0.80 0.00 0.00 31.60 30.79 1tv4 h MET 69 CO -0.02 0.48 0.38 1.25 0.23 0.00 0.00 176.91 179.23 1tv4 h LEU 70 N 0.04 0.77 -0.22 3.39 5.85 -1.00 -0.18 115.31 123.95 1tv4 h LEU 70 Ca 0.05 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.68 1tv4 h LEU 70 Cb 0.35 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 1tv4 h LEU 70 CO 0.01 0.61 0.07 0.25 -0.34 0.00 0.00 178.44 179.03 1tv4 h LEU 71 N 0.86 0.33 0.00 2.25 5.85 -1.03 -1.08 115.31 122.48 1tv4 h LEU 71 Ca 0.23 -0.21 -0.18 0.00 0.84 0.00 0.00 57.88 58.55 1tv4 h LEU 71 Cb -0.01 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 1tv4 h LEU 71 CO -0.04 0.45 -0.92 -0.33 -0.34 0.00 0.00 178.44 177.25 1tv4 h GLU 72 N 0.19 0.00 0.00 1.25 5.08 -0.79 -3.39 114.58 116.92 1tv4 h GLU 72 Ca 0.07 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.29 1tv4 h GLU 72 Cb 0.24 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 1tv4 h GLU 72 CO -0.00 0.80 -0.97 0.00 -1.00 0.00 0.00 179.01 177.83 1tv4 n GLY 74 N 1.51 -1.77 3.16 0.00 0.00 -0.41 -4.87 105.19 102.80 1tv4 n GLY 74 Ca -0.22 -1.72 -0.29 0.00 0.00 0.00 0.00 46.02 43.79 1tv4 n GLY 74 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1tv4 s ILE 75 N 0.00 1.70 -0.06 -0.61 -1.09 0.38 -4.89 121.20 116.63 1tv4 s ILE 75 Ca 0.00 -0.83 -0.26 0.00 -2.23 0.00 0.00 60.65 57.34 1tv4 s ILE 75 Cb 0.00 -1.48 -0.03 0.00 -1.58 0.00 0.00 42.46 39.37 1tv4 s ILE 75 CO 0.00 0.48 0.81 -0.47 -1.23 0.00 0.00 174.94 174.53 1tv4 s TYR 76 N 0.33 3.58 -0.37 3.97 5.04 -0.69 -0.39 117.35 128.81 1tv4 s TYR 76 Ca -0.14 1.39 -0.12 0.00 -2.44 0.00 0.00 57.07 55.75 1tv4 s TYR 76 Cb -0.16 -2.93 0.01 0.00 0.35 0.00 0.00 41.96 39.22 1tv4 s TYR 76 CO 0.06 0.00 0.24 0.00 -1.34 0.00 0.00 175.55 174.51 1tv4 h THR 78 N 5.68 1.16 -0.50 0.00 1.35 -1.68 0.47 112.91 119.38 1tv4 h THR 78 Ca -0.28 -0.39 -0.03 0.00 -0.55 0.00 0.00 66.41 65.16 1tv4 h THR 78 Cb 1.13 -0.07 -0.02 0.00 -1.73 0.00 0.00 68.15 67.46 1tv4 h THR 78 CO 0.67 0.21 0.21 0.44 -0.25 0.00 0.00 175.52 176.80 1tv4 h ASP 79 N 1.13 0.68 -0.00 5.36 3.32 -1.94 -3.23 116.42 121.75 1tv4 h ASP 79 Ca 0.35 -0.16 0.00 0.00 0.02 0.00 0.00 57.03 57.25 1tv4 h ASP 79 Cb -0.00 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.37 1tv4 h ASP 79 CO -0.10 0.65 -0.59 0.35 -1.72 0.00 0.00 179.24 177.83 1tv4 n THR 80 N -4.57 0.00 -3.51 0.35 -2.24 -1.16 -4.97 114.28 98.18 1tv4 n THR 80 Ca 0.02 -0.20 -0.26 0.00 -2.27 0.00 0.00 64.05 61.34 1tv4 n THR 80 Cb 0.14 1.17 0.02 0.00 -2.10 0.00 0.00 70.33 69.56 1tv4 n THR 80 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1tv4 n HIS 81 N -0.37 -2.07 -4.30 4.78 8.25 0.15 -4.93 115.22 116.73 1tv4 n HIS 81 Ca 0.08 0.67 -0.16 0.00 -0.26 0.00 0.00 57.72 58.05 1tv4 n HIS 81 Cb 0.43 -3.77 -0.10 0.00 1.12 0.00 0.00 29.99 27.68 1tv4 n HIS 81 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1tv4 s ARG 82 N -6.20 1.20 -0.17 -0.41 0.52 -1.21 -1.28 118.95 111.41 1tv4 s ARG 82 Ca 0.49 -1.52 -0.07 0.00 -0.52 0.00 0.00 55.73 54.12 1tv4 s ARG 82 Cb -0.25 -0.88 -0.04 0.00 0.52 0.00 0.00 34.95 34.30 1tv4 s ARG 82 CO 0.61 0.13 0.06 0.42 0.02 0.00 0.00 175.30 176.55 1tv4 s ILE 83 N -3.12 4.82 -0.20 1.52 1.01 -0.35 -1.39 121.20 123.49 1tv4 s ILE 83 Ca 0.19 -0.03 -0.12 0.00 0.00 0.00 0.00 60.65 60.69 1tv4 s ILE 83 Cb 0.01 -3.15 -0.05 0.00 0.01 0.00 0.00 42.46 39.28 1tv4 s ILE 83 CO 0.04 0.49 0.23 -0.69 0.00 0.00 0.00 174.94 175.01 1tv4 s VAL 84 N 0.08 5.33 -0.06 2.92 1.01 0.47 -3.50 120.40 126.66 1tv4 s VAL 84 Ca 0.05 0.37 0.03 0.00 0.00 0.00 0.00 61.98 62.43 1tv4 s VAL 84 Cb -0.12 -3.57 -0.03 0.00 0.00 0.00 0.00 36.38 32.67 1tv4 s VAL 84 CO 0.01 0.37 -0.12 -0.54 0.00 0.00 0.00 175.10 174.82 1tv4 s LYS 85 N 0.74 2.61 0.29 2.72 -0.14 -1.26 -0.47 119.74 124.23 1tv4 s LYS 85 Ca 0.12 -0.65 0.07 0.00 -1.36 0.00 0.00 55.97 54.15 1tv4 s LYS 85 Cb -0.13 -2.45 -0.03 0.00 -1.68 0.00 0.00 37.83 33.54 1tv4 s LYS 85 CO 0.03 0.62 0.28 0.71 -0.76 0.00 0.00 175.35 176.24 1tv4 s TYR 86 N -0.72 3.07 0.30 3.18 1.51 -1.26 -5.05 117.35 118.39 1tv4 s TYR 86 Ca 0.11 -0.18 0.07 0.00 -1.01 0.00 0.00 57.07 56.05 1tv4 s TYR 86 Cb -0.11 -1.64 -0.03 0.00 -0.11 0.00 0.00 41.96 40.08 1tv4 s TYR 86 CO 0.01 0.32 0.30 0.95 -1.11 0.00 0.00 175.55 176.03 1tv4 s THR 87 N -2.18 4.06 0.23 -0.71 -4.23 -1.26 -4.91 115.64 106.64 1tv4 s THR 87 Ca 0.37 -1.27 -0.07 0.00 -1.18 0.00 0.00 61.69 59.54 1tv4 s THR 87 Cb -0.07 -3.35 0.21 0.00 1.34 0.00 0.00 72.50 70.62 1tv4 s THR 87 CO 0.27 -0.24 1.85 -0.08 -0.54 0.00 0.00 174.62 175.88 1tv4 h GLU 88 N 1.24 1.25 -0.45 3.99 4.81 -2.00 -2.45 114.58 120.97 1tv4 h GLU 88 Ca -0.47 -0.15 -0.07 0.00 -0.13 0.00 0.00 59.36 58.54 1tv4 h GLU 88 Cb 1.25 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 30.37 1tv4 h GLU 88 CO 0.58 0.92 -0.01 -0.44 -0.73 0.00 0.00 179.01 179.33 1tv4 h ASP 89 N 1.25 0.72 -0.58 1.04 3.32 -1.96 -1.97 116.42 118.24 1tv4 h ASP 89 Ca 0.31 -0.17 -0.10 0.00 0.02 0.00 0.00 57.03 57.09 1tv4 h ASP 89 Cb 0.05 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 1tv4 h ASP 89 CO -0.05 0.79 -0.03 -0.33 -1.72 0.00 0.00 179.24 177.91 1tv4 h GLU 90 N 0.70 1.03 -0.45 3.56 5.08 -1.88 -1.57 114.58 121.05 1tv4 h GLU 90 Ca 0.14 -0.34 -0.04 0.00 -1.00 0.00 0.00 59.36 58.11 1tv4 h GLU 90 Cb 0.44 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 1tv4 h GLU 90 CO 0.02 1.03 0.11 0.82 -1.00 0.00 0.00 179.01 179.99 1tv4 h ILE 91 N 0.92 1.23 -0.41 3.13 2.04 -1.16 -2.44 117.51 120.83 1tv4 h ILE 91 Ca 0.16 -0.81 -0.09 0.00 1.00 0.00 0.00 64.86 65.12 1tv4 h ILE 91 Cb 0.58 0.91 -0.02 0.00 -0.74 0.00 0.00 36.82 37.55 1tv4 h ILE 91 CO 0.03 0.29 -0.12 -0.50 0.00 0.00 0.00 178.15 177.85 1tv4 h TRP 92 N 0.59 0.80 -0.96 1.37 -0.00 -1.27 -0.93 115.95 115.55 1tv4 h TRP 92 Ca 0.14 -0.14 0.00 0.00 -0.00 0.00 0.00 58.89 58.89 1tv4 h TRP 92 Cb 0.32 -0.21 -0.05 0.00 -0.00 0.00 0.00 29.16 29.22 1tv4 h TRP 92 CO 0.02 0.81 0.62 0.22 -0.00 0.00 0.00 178.44 180.11 1tv4 h ASP 93 N 0.66 1.12 -0.01 -3.49 1.82 -1.10 0.29 116.42 115.71 1tv4 h ASP 93 Ca 0.11 -0.04 -0.00 0.00 -0.39 0.00 0.00 57.03 56.71 1tv4 h ASP 93 Cb 0.58 -0.28 -0.00 0.00 0.68 0.00 0.00 39.33 40.31 1tv4 h ASP 93 CO 0.04 0.83 -0.01 0.00 -1.61 0.00 0.00 179.24 178.49 1tv4 h ALA 94 N 1.37 0.02 -0.70 -0.78 0.00 -1.01 -2.95 119.26 115.22 1tv4 h ALA 94 Ca 0.35 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 1tv4 h ALA 94 Cb -0.12 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1tv4 h ALA 94 CO -0.07 -0.25 0.24 0.82 0.00 0.00 0.00 179.25 179.99 1tv4 h ILE 95 N -0.40 1.25 0.00 0.00 2.04 -0.91 -2.73 117.51 116.76 1tv4 h ILE 95 Ca 0.00 -0.82 0.00 0.00 1.00 0.00 0.00 64.86 65.05 1tv4 h ILE 95 Cb 0.45 0.45 0.00 0.00 -0.74 0.00 0.00 36.82 36.98 1tv4 h ILE 95 CO 0.00 0.32 0.00 0.59 0.00 0.00 0.00 178.15 179.07 1tv4 n ASN 96 N -4.28 0.15 -3.18 1.72 3.02 0.10 -3.88 115.26 108.90 1tv4 n ASN 96 Ca 0.06 0.53 -0.23 0.00 -0.03 0.00 0.00 54.58 54.91 1tv4 n ASN 96 Cb 0.20 -0.56 -0.05 0.00 -0.61 0.00 0.00 39.78 38.76 1tv4 n ASN 96 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1tv4 n ASN 97 N -1.65 1.70 -4.95 6.41 4.13 -1.03 -5.07 115.26 114.80 1tv4 n ASN 97 Ca 0.04 -3.09 -0.24 0.00 1.68 0.00 0.00 54.58 52.97 1tv4 n ASN 97 Cb 0.22 -0.62 -0.02 0.00 -1.54 0.00 0.00 39.78 37.81 1tv4 n ASN 97 CO 0.00 0.00 0.00 0.68 0.28 0.00 0.00 177.26 178.22 1tv4 s VAL 98 N -2.38 5.24 0.08 2.41 -7.23 -1.24 -4.91 120.40 112.37 1tv4 s VAL 98 Ca 0.40 -0.69 -0.31 0.00 -1.81 0.00 0.00 61.98 59.57 1tv4 s VAL 98 Cb 0.25 -3.80 -0.09 0.00 0.56 0.00 0.00 36.38 33.30 1tv4 s VAL 98 CO -0.09 -0.27 1.66 -1.58 -0.31 0.00 0.00 175.10 174.51 1tv4 s GLN 99 N -3.70 4.19 0.05 4.82 0.74 -1.26 -4.90 119.66 119.61 1tv4 s GLN 99 Ca 0.36 2.36 -0.18 0.00 0.05 0.00 0.00 55.36 57.95 1tv4 s GLN 99 Cb -0.10 -3.56 -0.15 0.00 1.10 0.00 0.00 33.01 30.30 1tv4 s GLN 99 CO 0.30 -0.73 1.29 -0.22 -0.55 0.00 0.00 175.29 175.37 1tv4 h LYS 100 N 8.22 0.53 -2.71 1.67 3.64 -1.92 -3.42 116.57 122.58 1tv4 h LYS 100 Ca -0.43 -0.37 0.11 0.00 -1.27 0.00 0.00 60.65 58.69 1tv4 h LYS 100 Cb 1.20 0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 33.01 1tv4 h LYS 100 CO 0.93 0.98 0.34 -1.83 -2.27 0.00 0.00 179.45 177.61 1tv4 s GLU 101 N -3.93 1.47 0.15 1.90 -1.05 -1.26 -4.39 118.70 111.60 1tv4 s GLU 101 Ca -0.13 -0.79 -0.24 0.00 -0.15 0.00 0.00 54.97 53.66 1tv4 s GLU 101 Cb 0.06 0.52 0.06 0.00 -0.44 0.00 0.00 34.13 34.33 1tv4 s GLU 101 CO 0.81 -0.67 0.78 -0.59 0.95 0.00 0.00 175.26 176.55 1tv4 s PHE 102 N -3.62 -0.30 -0.07 4.83 -0.12 -1.06 -5.02 117.98 112.62 1tv4 s PHE 102 Ca 0.10 0.02 0.01 0.00 -0.05 0.00 0.00 56.93 57.01 1tv4 s PHE 102 Cb -0.04 0.61 -0.03 0.00 -0.63 0.00 0.00 43.02 42.94 1tv4 s PHE 102 CO 0.03 -0.88 -0.07 0.08 -0.05 0.00 0.00 175.22 174.32 1tv4 s VAL 103 N -3.54 3.67 -0.02 -2.49 1.01 -1.26 -0.69 120.40 117.07 1tv4 s VAL 103 Ca 0.07 -0.49 0.06 0.00 0.00 0.00 0.00 61.98 61.63 1tv4 s VAL 103 Cb -0.02 -2.50 -0.02 0.00 0.00 0.00 0.00 36.38 33.83 1tv4 s VAL 103 CO -0.03 0.59 -0.20 -0.76 0.00 0.00 0.00 175.10 174.70 1tv4 s LEU 104 N -0.72 2.41 0.00 3.92 1.43 -0.44 -4.84 118.68 120.43 1tv4 s LEU 104 Ca 0.11 -0.37 0.00 0.00 -1.03 0.00 0.00 54.13 52.84 1tv4 s LEU 104 Cb -0.11 -1.45 0.00 0.00 0.03 0.00 0.00 46.19 44.66 1tv4 s LEU 104 CO 0.02 0.32 0.00 0.61 0.23 0.00 0.00 176.35 177.52 1tv4 n GLY 105 N 2.20 -2.51 3.23 -3.19 0.00 -0.67 -0.80 105.19 103.46 1tv4 n GLY 105 Ca -0.17 -1.61 -0.13 0.00 0.00 0.00 0.00 46.02 44.12 1tv4 n GLY 105 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1tv4 s THR 106 N -0.93 0.00 0.00 2.61 -4.23 0.82 -4.63 115.64 109.28 1tv4 s THR 106 Ca 0.00 -1.97 0.00 0.00 -1.18 0.00 0.00 61.69 58.54 1tv4 s THR 106 Cb 0.00 -2.49 0.00 0.00 1.34 0.00 0.00 72.50 71.35 1tv4 s THR 106 CO 0.00 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.69 1tv4 n GLY 107 N -0.32 1.65 0.25 3.99 0.00 -1.26 -2.32 105.19 107.17 1tv4 n GLY 107 Ca 0.02 -0.50 0.08 0.00 0.00 0.00 0.00 46.02 45.62 1tv4 n GLY 107 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1tv4 h ARG 108 N 0.00 0.00 -0.01 1.61 1.12 -1.99 -2.92 114.38 112.19 1tv4 h ARG 108 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.87 1tv4 h ARG 108 Cb 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 29.96 1tv4 h ARG 108 CO 0.00 0.09 -0.02 -0.25 -3.11 0.00 0.00 179.97 176.68 1tv4 n ASP 109 N -4.29 0.55 -4.77 -3.80 10.43 -1.02 -4.91 116.55 108.73 1tv4 n ASP 109 Ca -0.03 -1.07 -0.34 0.00 2.57 0.00 0.00 54.79 55.92 1tv4 n ASP 109 Cb 0.17 -0.02 0.02 0.00 1.84 0.00 0.00 41.12 43.13 1tv4 n ASP 109 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1tv4 s ALA 110 N -2.09 2.62 0.02 2.24 0.00 -0.98 -4.53 121.76 119.04 1tv4 s ALA 110 Ca 0.41 0.71 0.02 0.00 0.00 0.00 0.00 51.96 53.10 1tv4 s ALA 110 Cb 0.21 -3.34 -0.02 0.00 0.00 0.00 0.00 23.12 19.98 1tv4 s ALA 110 CO 0.38 -0.94 -0.07 0.14 0.00 0.00 0.00 175.76 175.27 1tv4 s VAL 111 N -1.99 0.48 -0.05 0.00 -7.23 0.02 -4.95 120.40 106.68 1tv4 s VAL 111 Ca 0.70 -0.70 -0.16 0.00 -1.81 0.00 0.00 61.98 60.01 1tv4 s VAL 111 Cb -0.22 -0.49 -0.05 0.00 0.56 0.00 0.00 36.38 36.18 1tv4 s VAL 111 CO 0.32 -0.17 0.44 0.20 -0.31 0.00 0.00 175.10 175.58 1tv4 s ASN 112 N -0.94 6.75 -0.28 4.85 -0.87 -1.26 -1.33 114.94 121.85 1tv4 s ASN 112 Ca -0.05 0.89 -0.06 0.00 -1.57 0.00 0.00 52.86 52.07 1tv4 s ASN 112 Cb -0.06 -2.27 0.01 0.00 -0.02 0.00 0.00 41.25 38.91 1tv4 s ASN 112 CO 0.00 0.18 0.06 -0.69 -2.57 0.00 0.00 177.10 174.08 1tv4 s VAL 113 N -0.31 3.87 0.16 1.60 1.01 0.13 -5.00 120.40 121.86 1tv4 s VAL 113 Ca 0.24 -0.67 0.07 0.00 0.00 0.00 0.00 61.98 61.62 1tv4 s VAL 113 Cb -0.16 -2.97 -0.04 0.00 0.00 0.00 0.00 36.38 33.21 1tv4 s VAL 113 CO 0.12 0.13 -0.14 -0.13 0.00 0.00 0.00 175.10 175.07 1tv4 s ARG 114 N 1.49 1.18 0.39 2.72 0.52 -1.26 -2.56 118.95 121.42 1tv4 s ARG 114 Ca 0.03 -1.43 -0.27 0.00 -0.52 0.00 0.00 55.73 53.53 1tv4 s ARG 114 Cb -0.17 -1.00 -0.10 0.00 0.52 0.00 0.00 34.95 34.20 1tv4 s ARG 114 CO 0.02 0.18 1.44 0.21 0.02 0.00 0.00 175.30 177.16 1tv4 s LYS 115 N -3.23 4.05 0.02 3.54 2.20 -1.26 -4.87 119.74 120.18 1tv4 s LYS 115 Ca 0.16 2.47 0.08 0.00 -0.36 0.00 0.00 55.97 58.32 1tv4 s LYS 115 Cb -0.02 -2.90 -0.03 0.00 -1.51 0.00 0.00 37.83 33.36 1tv4 s LYS 115 CO 0.04 -0.54 -0.22 1.03 -0.36 0.00 0.00 175.35 175.30 1tv4 s ARG 116 N -2.14 2.02 0.49 4.03 0.52 -1.26 -5.09 118.95 117.52 1tv4 s ARG 116 Ca 0.54 -0.99 0.08 0.00 -0.52 0.00 0.00 55.73 54.84 1tv4 s ARG 116 Cb -0.44 -2.11 0.04 0.00 0.52 0.00 0.00 34.95 32.96 1tv4 s ARG 116 CO 0.59 0.54 0.68 -1.12 0.02 0.00 0.00 175.30 176.01 1tv4 s SER 117 N -1.16 5.40 0.25 0.23 0.01 -1.26 -4.75 113.70 112.42 1tv4 s SER 117 Ca 0.13 -0.58 -0.31 0.00 1.31 0.00 0.00 55.95 56.50 1tv4 s SER 117 Cb -0.10 -0.26 -0.11 0.00 0.21 0.00 0.00 66.02 65.76 1tv4 s SER 117 CO 0.03 -1.03 1.59 -0.69 0.41 0.00 0.00 173.24 173.55 1tv4 s VAL 118 N -2.51 2.22 -0.41 3.43 1.01 -1.26 -1.66 120.40 121.22 1tv4 s VAL 118 Ca 0.58 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.73 1tv4 s VAL 118 Cb -0.08 -3.11 0.00 0.00 0.00 0.00 0.00 36.38 33.19 1tv4 s VAL 118 CO 0.36 0.02 0.00 0.61 0.00 0.00 0.00 175.10 176.09 1tv4 n GLY 119 N 2.70 0.55 3.61 4.51 0.00 0.54 -4.94 105.19 112.16 1tv4 n GLY 119 Ca 0.10 -0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 1tv4 n GLY 119 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1tv4 n ASP 120 N -0.43 1.34 0.24 1.61 4.64 -0.66 -3.47 116.55 119.81 1tv4 n ASP 120 Ca -0.04 1.09 0.14 0.00 -1.38 0.00 0.00 54.79 54.60 1tv4 n ASP 120 Cb 0.34 -1.34 0.36 0.00 -1.04 0.00 0.00 41.12 39.44 1tv4 n ASP 120 CO 0.00 0.00 0.00 0.11 -0.82 0.00 0.00 177.20 176.49 1tv4 h LYS 121 N 1.74 0.00 -7.00 -0.67 1.57 -1.90 -1.93 116.57 108.37 1tv4 h LYS 121 Ca -0.43 0.00 -0.48 0.00 -1.87 0.00 0.00 60.65 57.87 1tv4 h LYS 121 Cb 1.34 0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.67 1tv4 h LYS 121 CO 0.58 0.00 0.41 0.00 -0.57 0.00 0.00 179.45 179.87 1tv4 s ALA 122 N -3.38 3.00 0.07 3.86 0.00 -1.26 -4.49 121.76 119.55 1tv4 s ALA 122 Ca 0.05 0.69 -0.17 0.00 0.00 0.00 0.00 51.96 52.52 1tv4 s ALA 122 Cb 0.06 -3.28 -0.06 0.00 0.00 0.00 0.00 23.12 19.85 1tv4 s ALA 122 CO 0.62 -0.29 0.53 0.21 0.00 0.00 0.00 175.76 176.83 1tv4 s LYS 123 N -2.77 4.09 0.85 0.00 2.20 -1.26 -4.85 119.74 118.01 1tv4 s LYS 123 Ca 0.62 0.61 -0.12 0.00 -0.36 0.00 0.00 55.97 56.72 1tv4 s LYS 123 Cb -0.21 -3.18 0.10 0.00 -1.51 0.00 0.00 37.83 33.04 1tv4 s LYS 123 CO 0.25 0.62 1.10 -1.25 -0.36 0.00 0.00 175.35 175.72 1tv4 s PRO 124 N -1.26 1.62 0.15 4.03 0.04 -1.26 -4.99 135.00 133.33 1tv4 s PRO 124 Ca 0.29 0.66 -0.30 0.00 0.04 0.00 0.00 61.00 61.69 1tv4 s PRO 124 Cb -0.18 -1.86 -0.07 0.00 0.04 0.00 0.00 34.50 32.43 1tv4 s PRO 124 CO 0.18 -1.95 1.15 0.42 0.04 0.00 0.00 177.00 176.83 1tv4 s ILE 125 N -3.08 3.86 -0.43 0.56 -1.09 0.34 -4.90 121.20 116.46 1tv4 s ILE 125 Ca 0.62 1.51 -0.16 0.00 -2.23 0.00 0.00 60.65 60.40 1tv4 s ILE 125 Cb -0.16 -3.97 0.03 0.00 -1.58 0.00 0.00 42.46 36.78 1tv4 s ILE 125 CO 0.55 0.22 0.37 -0.69 -1.23 0.00 0.00 174.94 174.16 1tv4 s VAL 126 N 0.15 5.19 -0.55 2.92 1.01 -1.26 -0.85 120.40 127.00 1tv4 s VAL 126 Ca 0.52 -0.62 -0.13 0.00 0.00 0.00 0.00 61.98 61.76 1tv4 s VAL 126 Cb -0.30 -4.00 0.14 0.00 0.00 0.00 0.00 36.38 32.21 1tv4 s VAL 126 CO 0.34 -0.40 0.47 -1.58 0.00 0.00 0.00 175.10 173.93 1tv4 s GLN 127 N 1.85 2.85 -0.01 2.72 0.74 0.10 0.03 119.66 127.94 1tv4 s GLN 127 Ca 0.07 -1.86 -0.00 0.00 0.05 0.00 0.00 55.36 53.62 1tv4 s GLN 127 Cb -0.19 -4.15 -0.04 0.00 1.10 0.00 0.00 33.01 29.73 1tv4 s GLN 127 CO 0.11 -1.27 0.07 0.20 -0.55 0.00 0.00 175.29 173.85 1tv4 s GLY 128 N 2.94 2.00 0.00 2.59 0.00 -0.44 -1.53 107.32 112.89 1tv4 s GLY 128 Ca 0.06 -0.88 0.00 0.00 0.00 0.00 0.00 44.72 43.91 1tv4 s GLY 128 CO -0.00 -0.75 0.00 0.61 0.00 0.00 0.00 173.10 172.96 1tv4 n GLY 129 N 1.22 -0.84 0.08 0.20 0.00 -0.22 -2.13 105.19 103.50 1tv4 n GLY 129 Ca -0.13 -1.15 0.06 0.00 0.00 0.00 0.00 46.02 44.80 1tv4 n GLY 129 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1tv4 n PRO 130 N -0.49 0.07 -3.69 1.61 -0.02 -1.19 -2.38 135.00 128.92 1tv4 n PRO 130 Ca 0.00 0.56 -0.24 0.00 -2.02 0.00 0.00 63.50 61.80 1tv4 n PRO 130 Cb 0.00 -1.74 0.03 0.00 -0.02 0.00 0.00 33.50 31.77 1tv4 n PRO 130 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1tv4 n THR 131 N -1.89 -5.06 -0.92 3.45 -1.04 -1.21 -1.91 114.28 105.70 1tv4 n THR 131 Ca -0.00 -0.70 0.00 0.00 -2.04 0.00 0.00 64.05 61.30 1tv4 n THR 131 Cb 0.03 -4.01 0.00 0.00 -1.82 0.00 0.00 70.33 64.53 1tv4 n THR 131 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1tv4 n GLY 132 N -1.63 0.64 3.80 3.41 0.00 0.23 -4.69 105.19 106.95 1tv4 n GLY 132 Ca -0.23 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.46 1tv4 n GLY 132 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1tv4 s SER 133 N -2.52 6.15 0.07 1.61 0.01 -0.80 -4.17 113.70 114.05 1tv4 s SER 133 Ca 0.00 1.90 -0.31 0.00 1.31 0.00 0.00 55.95 58.85 1tv4 s SER 133 Cb 0.00 -2.55 -0.07 0.00 0.21 0.00 0.00 66.02 63.61 1tv4 s SER 133 CO 0.00 -0.92 1.46 -2.16 0.41 0.00 0.00 173.24 172.03 1tv4 s PRO 134 N -3.50 4.27 -0.07 12.44 0.04 -1.26 -0.67 135.00 146.25 1tv4 s PRO 134 Ca 0.66 2.11 0.03 0.00 0.04 0.00 0.00 61.00 63.84 1tv4 s PRO 134 Cb -0.17 -3.43 0.01 0.00 0.04 0.00 0.00 34.50 30.95 1tv4 s PRO 134 CO 0.26 -0.56 -0.16 0.42 0.04 0.00 0.00 177.00 177.00 1tv4 s ILE 135 N 1.89 1.42 0.40 0.56 -1.09 0.55 -0.63 121.20 124.29 1tv4 s ILE 135 Ca 0.67 -0.66 -0.27 0.00 -2.23 0.00 0.00 60.65 58.16 1tv4 s ILE 135 Cb -0.36 -1.26 -0.10 0.00 -1.58 0.00 0.00 42.46 39.16 1tv4 s ILE 135 CO 0.29 0.42 1.40 -1.20 -1.23 0.00 0.00 174.94 174.62 1tv4 n SER 136 N 3.61 3.29 -0.24 3.58 7.64 -1.26 -1.96 113.62 128.28 1tv4 n SER 136 Ca -0.21 1.18 0.01 0.00 1.01 0.00 0.00 58.87 60.85 1tv4 n SER 136 Cb 0.52 -1.57 0.13 0.00 -1.01 0.00 0.00 64.21 62.28 1tv4 n SER 136 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1tv4 h GLU 137 N 2.56 0.61 0.00 1.43 4.81 -1.95 -2.33 114.58 119.70 1tv4 h GLU 137 Ca -0.49 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.70 1tv4 h GLU 137 Cb 1.27 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.51 1tv4 h GLU 137 CO 0.62 0.40 0.00 -0.40 -0.73 0.00 0.00 179.01 178.90 1tv4 n ASP 138 N -4.84 0.00 -0.22 1.04 5.68 -1.26 -2.42 116.55 114.53 1tv4 n ASP 138 Ca 0.10 0.18 0.06 0.00 -0.50 0.00 0.00 54.79 54.64 1tv4 n ASP 138 Cb 0.25 -0.34 0.08 0.00 -1.14 0.00 0.00 41.12 39.97 1tv4 n ASP 138 CO 0.00 0.00 0.00 1.33 -1.33 0.00 0.00 177.20 177.20 1tv4 n VAL 139 N -1.34 1.14 0.01 2.12 0.24 -0.91 -4.85 118.33 114.75 1tv4 n VAL 139 Ca 0.06 -1.37 -0.11 0.00 -2.04 0.00 0.00 64.34 60.88 1tv4 n VAL 139 Cb 0.12 0.07 -0.05 0.00 -1.47 0.00 0.00 33.84 32.51 1tv4 n VAL 139 CO 0.00 0.00 0.00 0.15 -2.14 0.00 0.00 176.83 174.84 1tv4 h PHE 140 N 0.00 -0.05 -0.14 6.34 3.57 -1.12 -0.37 116.94 125.17 1tv4 h PHE 140 Ca 0.00 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.46 1tv4 h PHE 140 Cb 1.13 0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.91 1tv4 h PHE 140 CO 0.04 -0.04 -0.11 0.52 -2.23 0.00 0.00 178.31 176.49 1tv4 h MET 141 N -0.01 0.33 -0.63 1.11 2.86 -1.87 -2.78 114.93 113.94 1tv4 h MET 141 Ca 0.04 -0.16 0.09 0.00 -2.06 0.00 0.00 59.70 57.61 1tv4 h MET 141 Cb 0.07 -0.00 -0.07 0.00 0.06 0.00 0.00 31.60 31.66 1tv4 h MET 141 CO -0.09 0.69 0.27 -1.35 1.06 0.00 0.00 176.91 177.50 1tv4 h PRO 142 N -0.03 0.47 -0.26 -0.22 0.11 -1.87 0.15 132.00 130.35 1tv4 h PRO 142 Ca 0.03 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1tv4 h PRO 142 Cb 0.62 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.61 1tv4 h PRO 142 CO 0.03 0.31 0.17 0.28 -0.21 0.00 0.00 178.00 178.58 1tv4 h VAL 143 N 0.48 1.06 0.00 3.15 2.07 -1.07 -2.08 116.25 119.86 1tv4 h VAL 143 Ca 0.31 -0.12 -0.09 0.00 0.82 0.00 0.00 66.70 67.62 1tv4 h VAL 143 Cb 0.35 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 1tv4 h VAL 143 CO -0.28 0.06 -0.43 0.45 0.02 0.00 0.00 177.57 177.39 1tv4 h HIS 144 N 0.35 0.00 0.00 1.57 3.86 -1.13 -2.20 115.15 117.59 1tv4 h HIS 144 Ca 0.10 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.27 1tv4 h HIS 144 Cb -0.04 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.43 1tv4 h HIS 144 CO -0.06 0.43 -0.16 1.98 0.86 0.00 0.00 177.93 180.98 1tv4 h MET 145 N 0.00 0.00 0.00 2.45 -1.53 -0.15 -1.15 114.93 114.56 1tv4 h MET 145 Ca -0.00 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.26 1tv4 h MET 145 Cb 0.77 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.82 1tv4 h MET 145 CO 0.06 0.16 0.00 0.66 0.14 0.00 0.00 176.91 177.93 1tv4 h SER 146 N 0.00 0.00 0.05 1.39 4.64 -0.74 -0.34 113.55 118.56 1tv4 h SER 146 Ca -0.00 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 60.95 1tv4 h SER 146 Cb 0.32 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.37 1tv4 h SER 146 CO 0.02 0.00 -2.12 -1.22 -0.87 0.00 0.00 176.83 172.64 1tv4 n TYR 147 N -2.85 0.64 0.24 4.77 4.02 -0.47 -4.07 117.16 119.44 1tv4 n TYR 147 Ca -0.01 0.17 0.07 0.00 -0.01 0.00 0.00 57.90 58.12 1tv4 n TYR 147 Cb 0.16 -1.08 0.57 0.00 -0.02 0.00 0.00 39.34 38.96 1tv4 n TYR 147 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1tv4 h ALA 148 N -0.19 1.80 0.00 -0.72 0.00 -1.10 -1.74 119.26 117.32 1tv4 h ALA 148 Ca -0.50 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1tv4 h ALA 148 Cb 1.82 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.60 1tv4 h ALA 148 CO -0.09 0.13 0.00 1.28 0.00 0.00 0.00 179.25 180.58 1tv4 n LEU 149 N -4.38 0.29 -4.62 0.00 4.77 -0.17 -4.67 117.00 108.22 1tv4 n LEU 149 Ca -0.03 0.55 -0.41 0.00 -0.03 0.00 0.00 56.01 56.10 1tv4 n LEU 149 Cb 0.18 -0.48 -0.07 0.00 -2.33 0.00 0.00 43.42 40.73 1tv4 n LEU 149 CO 0.35 -0.22 0.36 -1.61 -1.33 0.00 0.00 177.39 174.94 1tv4 s GLU 150 N -3.08 4.04 0.62 3.23 0.41 -0.65 -4.93 118.70 118.33 1tv4 s GLU 150 Ca 0.09 0.43 0.38 0.00 -0.41 0.00 0.00 54.97 55.46 1tv4 s GLU 150 Cb 0.13 -3.67 2.05 0.00 -1.78 0.00 0.00 34.13 30.86 1tv4 s GLU 150 CO 0.44 -0.44 2.27 0.87 -0.49 0.00 0.00 175.26 177.90 1tv4 h LYS 151 N 8.00 0.00 0.00 1.61 1.57 -1.85 -1.51 116.57 124.39 1tv4 h LYS 151 Ca -0.27 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.46 1tv4 h LYS 151 Cb 1.13 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.43 1tv4 h LYS 151 CO 0.77 0.02 -0.21 0.93 -0.57 0.00 0.00 179.45 180.38 1tv4 h GLU 152 N 0.00 0.00 -6.24 3.15 4.39 -1.91 -3.43 114.58 110.54 1tv4 h GLU 152 Ca -0.00 0.00 -0.55 0.00 0.34 0.00 0.00 59.36 59.15 1tv4 h GLU 152 Cb 0.09 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.70 1tv4 h GLU 152 CO 0.00 0.21 0.18 0.08 -1.16 0.00 0.00 179.01 178.33 1tv4 s VAL 153 N -4.51 4.86 -0.26 3.13 1.01 -0.57 -4.58 120.40 119.47 1tv4 s VAL 153 Ca -0.04 1.67 -0.02 0.00 0.00 0.00 0.00 61.98 63.59 1tv4 s VAL 153 Cb 0.15 -4.14 -0.16 0.00 0.00 0.00 0.00 36.38 32.24 1tv4 s VAL 153 CO 0.69 0.28 -0.26 0.47 0.00 0.00 0.00 175.10 176.29 1tv4 n ASP 154 N 3.35 1.98 -4.28 3.32 8.00 0.10 -4.93 116.55 124.09 1tv4 n ASP 154 Ca -0.00 -0.01 -0.15 0.00 0.71 0.00 0.00 54.79 55.34 1tv4 n ASP 154 Cb 0.51 -0.52 -0.10 0.00 -0.02 0.00 0.00 41.12 40.98 1tv4 n ASP 154 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1tv4 s THR 155 N -2.52 0.43 -0.08 -3.53 -4.23 -0.96 -4.50 115.64 100.26 1tv4 s THR 155 Ca -0.36 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.17 1tv4 s THR 155 Cb 0.11 -2.55 -0.03 0.00 1.34 0.00 0.00 72.50 71.37 1tv4 s THR 155 CO 0.57 -0.05 -0.11 -0.63 -0.54 0.00 0.00 174.62 173.86 1tv4 s ILE 156 N -3.85 3.33 -0.27 2.99 -1.09 -0.26 -1.32 121.20 120.73 1tv4 s ILE 156 Ca 0.37 -0.61 -0.06 0.00 -2.23 0.00 0.00 60.65 58.12 1tv4 s ILE 156 Cb 0.07 -2.35 -0.00 0.00 -1.58 0.00 0.00 42.46 38.60 1tv4 s ILE 156 CO 0.12 0.58 0.06 0.54 -1.23 0.00 0.00 174.94 175.01 1tv4 s VAL 157 N -0.50 3.96 0.48 2.92 0.11 -0.90 -0.60 120.40 125.87 1tv4 s VAL 157 Ca 0.07 -0.52 -0.24 0.00 -2.93 0.00 0.00 61.98 58.37 1tv4 s VAL 157 Cb -0.12 -2.95 -0.07 0.00 -1.53 0.00 0.00 36.38 31.70 1tv4 s VAL 157 CO 0.02 0.21 1.33 0.59 -3.33 0.00 0.00 175.10 173.92 1tv4 n ASN 158 N 4.87 2.73 -4.45 3.54 3.02 -0.89 -3.15 115.26 120.94 1tv4 n ASN 158 Ca -0.16 1.05 -0.22 0.00 -0.03 0.00 0.00 54.58 55.23 1tv4 n ASN 158 Cb 0.49 -1.55 0.11 0.00 -0.61 0.00 0.00 39.78 38.22 1tv4 n ASN 158 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1tv4 n GLY 159 N 0.75 0.74 3.51 7.41 0.00 -1.26 -0.60 105.19 115.74 1tv4 n GLY 159 Ca 0.08 -2.04 -0.34 0.00 0.00 0.00 0.00 46.02 43.72 1tv4 n GLY 159 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1tv4 s VAL 160 N -2.90 3.76 -0.14 1.61 1.01 0.15 -4.54 120.40 119.35 1tv4 s VAL 160 Ca 0.63 -0.42 -0.29 0.00 0.00 0.00 0.00 61.98 61.89 1tv4 s VAL 160 Cb -0.04 -2.61 -0.02 0.00 0.00 0.00 0.00 36.38 33.72 1tv4 s VAL 160 CO 0.41 0.53 1.23 -0.04 0.00 0.00 0.00 175.10 177.23 1tv4 s MET 161 N 0.03 4.27 0.40 2.72 -1.94 -1.26 -0.33 119.30 123.18 1tv4 s MET 161 Ca -0.00 1.64 0.17 0.00 -1.71 0.00 0.00 55.69 55.79 1tv4 s MET 161 Cb -0.14 -3.69 0.84 0.00 2.01 0.00 0.00 34.83 33.85 1tv4 s MET 161 CO 0.03 -0.62 1.84 1.79 -0.01 0.00 0.00 175.02 178.05 1tv4 h THR 162 N 5.35 1.01 -2.99 2.05 1.35 -1.73 -3.44 112.91 114.51 1tv4 h THR 162 Ca -0.28 -1.23 -0.05 0.00 -0.55 0.00 0.00 66.41 64.30 1tv4 h THR 162 Cb 1.12 1.71 -0.14 0.00 -1.73 0.00 0.00 68.15 69.11 1tv4 h THR 162 CO 0.94 0.32 0.06 -0.94 -0.25 0.00 0.00 175.52 175.66 1tv4 s SER 163 N -6.62 -0.43 -0.05 5.36 1.04 -1.26 -4.44 113.70 107.30 1tv4 s SER 163 Ca -0.02 0.00 -0.01 0.00 0.48 0.00 0.00 55.95 56.40 1tv4 s SER 163 Cb 0.13 0.52 0.03 0.00 0.10 0.00 0.00 66.02 66.80 1tv4 s SER 163 CO 0.69 -0.83 0.02 0.54 0.98 0.00 0.00 173.24 174.63 1tv4 s VAL 164 N -3.17 0.20 -1.47 5.02 0.11 -0.22 -4.50 120.40 116.37 1tv4 s VAL 164 Ca -0.01 0.19 -0.08 0.00 -2.93 0.00 0.00 61.98 59.14 1tv4 s VAL 164 Cb -0.00 -0.36 0.03 0.00 -1.53 0.00 0.00 36.38 34.51 1tv4 s VAL 164 CO -0.08 0.21 0.79 0.54 -3.33 0.00 0.00 175.10 173.24 1tv4 n ARG 165 N 4.89 -5.55 -1.06 1.54 1.74 -1.26 -1.99 116.66 114.96 1tv4 n ARG 165 Ca -0.12 0.78 -0.02 0.00 -0.77 0.00 0.00 57.85 57.72 1tv4 n ARG 165 Cb 0.50 -5.67 -0.01 0.00 -1.02 0.00 0.00 32.46 26.26 1tv4 n ARG 165 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1tv4 n GLY 166 N -1.62 0.48 3.24 -0.13 0.00 -1.26 -5.02 105.19 100.88 1tv4 n GLY 166 Ca -0.04 -0.15 -0.23 0.00 0.00 0.00 0.00 46.02 45.59 1tv4 n GLY 166 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tv4 s LYS 167 N -1.32 1.16 0.26 1.61 -0.14 -0.84 -5.03 119.74 115.43 1tv4 s LYS 167 Ca 0.00 -1.00 -0.30 0.00 -1.36 0.00 0.00 55.97 53.32 1tv4 s LYS 167 Cb 0.00 -1.30 -0.10 0.00 -1.68 0.00 0.00 37.83 34.75 1tv4 s LYS 167 CO 0.00 0.32 1.33 -1.12 -0.76 0.00 0.00 175.35 175.12 1tv4 s SER 168 N -1.50 6.81 -1.56 2.83 0.01 -1.26 -1.06 113.70 117.96 1tv4 s SER 168 Ca 0.05 2.56 -0.10 0.00 1.31 0.00 0.00 55.95 59.78 1tv4 s SER 168 Cb -0.09 -2.63 -0.08 0.00 0.21 0.00 0.00 66.02 63.43 1tv4 s SER 168 CO 0.03 -0.56 2.87 -0.81 0.41 0.00 0.00 173.24 175.17 1tv4 n PRO 169 N 1.88 3.54 -1.63 12.44 -0.04 -1.26 -4.81 135.00 145.12 1tv4 n PRO 169 Ca 0.04 -2.16 -0.49 0.00 -0.04 0.00 0.00 63.50 60.85 1tv4 n PRO 169 Cb 0.42 -2.80 -0.05 0.00 -0.04 0.00 0.00 33.50 31.03 1tv4 n PRO 169 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1tv4 n ILE 170 N 3.71 0.02 -1.63 0.52 2.08 -1.26 -4.33 119.36 118.46 1tv4 n ILE 170 Ca 0.75 -0.00 -0.46 0.00 0.56 0.00 0.00 62.75 63.60 1tv4 n ILE 170 Cb 0.23 -1.17 -0.03 0.00 -0.75 0.00 0.00 39.64 37.92 1tv4 n ILE 170 CO 0.00 0.00 0.00 -2.65 0.56 0.00 0.00 176.55 174.46 1tv4 n PRO 171 N 3.04 1.66 -1.19 0.38 -0.02 -1.26 -1.29 135.00 136.32 1tv4 n PRO 171 Ca 0.18 0.59 -0.06 0.00 -2.02 0.00 0.00 63.50 62.18 1tv4 n PRO 171 Cb 0.23 -2.16 -0.03 0.00 -0.02 0.00 0.00 33.50 31.53 1tv4 n PRO 171 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1tv4 n LYS 172 N 1.72 -0.88 -4.07 -0.52 5.02 -1.26 -5.02 118.16 113.15 1tv4 n LYS 172 Ca 0.12 0.63 -0.22 0.00 -2.02 0.00 0.00 58.31 56.83 1tv4 n LYS 172 Cb 0.29 -4.52 -0.04 0.00 -0.02 0.00 0.00 35.03 30.74 1tv4 n LYS 172 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1tv4 s SER 173 N -2.52 5.42 0.58 4.39 1.04 -0.41 -5.00 113.70 117.19 1tv4 s SER 173 Ca 0.00 -0.32 0.34 0.00 0.48 0.00 0.00 55.95 56.45 1tv4 s SER 173 Cb 0.00 -1.29 1.76 0.00 0.10 0.00 0.00 66.02 66.59 1tv4 s SER 173 CO 0.00 -0.09 2.16 1.55 0.98 0.00 0.00 173.24 177.84 1tv4 h PRO 174 N 1.47 0.00 0.00 4.02 0.13 -1.95 -1.62 132.00 134.05 1tv4 h PRO 174 Ca -0.48 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.60 1tv4 h PRO 174 Cb 1.24 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.36 1tv4 h PRO 174 CO 0.60 0.05 -0.27 1.88 -0.23 0.00 0.00 178.00 180.03 1tv4 h TYR 175 N 0.00 0.00 -0.37 1.56 -1.99 -1.89 -1.06 116.97 113.22 1tv4 h TYR 175 Ca -0.00 0.00 -0.11 0.00 2.00 0.00 0.00 58.73 60.61 1tv4 h TYR 175 Cb 0.25 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.97 1tv4 h TYR 175 CO 0.00 0.27 -0.22 1.49 -0.00 0.00 0.00 178.16 179.70 1tv4 h GLU 176 N 0.00 0.80 -0.29 4.88 4.81 -1.44 -0.22 114.58 123.12 1tv4 h GLU 176 Ca -0.00 -0.37 -0.03 0.00 -0.13 0.00 0.00 59.36 58.83 1tv4 h GLU 176 Cb 0.58 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.94 1tv4 h GLU 176 CO 0.04 0.99 0.06 0.28 -0.73 0.00 0.00 179.01 179.65 1tv4 h VAL 177 N 0.59 1.22 -0.65 0.32 2.07 -1.48 -0.53 116.25 117.80 1tv4 h VAL 177 Ca 0.08 -0.76 0.06 0.00 0.82 0.00 0.00 66.70 66.90 1tv4 h VAL 177 Cb 0.78 1.17 -0.05 0.00 -1.52 0.00 0.00 31.29 31.66 1tv4 h VAL 177 CO 0.06 0.25 0.36 0.25 0.02 0.00 0.00 177.57 178.51 1tv4 h LEU 178 N 0.30 0.53 -0.51 2.57 5.85 -1.07 -2.31 115.31 120.66 1tv4 h LEU 178 Ca 0.09 0.03 -0.10 0.00 0.84 0.00 0.00 57.88 58.74 1tv4 h LEU 178 Cb 0.31 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 1tv4 h LEU 178 CO 0.00 0.34 -0.07 0.00 -0.34 0.00 0.00 178.44 178.38 1tv4 h ALA 179 N 1.34 0.69 -0.83 1.25 0.00 -0.83 0.50 119.26 121.38 1tv4 h ALA 179 Ca 0.29 -0.32 0.06 0.00 0.00 0.00 0.00 54.91 54.94 1tv4 h ALA 179 Cb 0.18 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 17.72 1tv4 h ALA 179 CO -0.18 0.56 0.51 0.00 0.00 0.00 0.00 179.25 180.14 1tv4 h ALA 180 N 0.92 1.14 0.03 0.00 0.00 -0.62 0.19 119.26 120.91 1tv4 h ALA 180 Ca 0.14 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 1tv4 h ALA 180 Cb 0.61 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.20 1tv4 h ALA 180 CO 0.04 0.24 -0.25 0.87 0.00 0.00 0.00 179.25 180.15 1tv4 h LYS 181 N 0.92 0.12 -0.65 0.00 1.57 -1.33 -3.37 116.57 113.83 1tv4 h LYS 181 Ca 0.36 -0.16 0.01 0.00 -1.87 0.00 0.00 60.65 58.99 1tv4 h LYS 181 Cb 0.18 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.51 1tv4 h LYS 181 CO -0.18 1.00 0.43 1.15 -0.57 0.00 0.00 179.45 181.28 1tv4 h THR 182 N -0.68 1.16 -0.87 -0.16 2.02 -0.74 -3.03 112.91 110.61 1tv4 h THR 182 Ca -0.04 -0.30 0.08 0.00 0.77 0.00 0.00 66.41 66.92 1tv4 h THR 182 Cb 1.10 0.21 -0.11 0.00 -1.74 0.00 0.00 68.15 67.62 1tv4 h THR 182 CO 0.05 0.16 -0.52 -0.08 0.37 0.00 0.00 175.52 175.50 1tv4 h GLU 183 N 0.88 -0.01 -0.01 6.66 4.81 -0.78 0.65 114.58 126.78 1tv4 h GLU 183 Ca 0.24 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.32 1tv4 h GLU 183 Cb -0.10 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.27 1tv4 h GLU 183 CO -0.05 -0.00 -0.68 1.15 -0.73 0.00 0.00 179.01 178.69 1tv4 h THR 184 N -0.01 1.47 -0.50 0.32 2.02 -1.75 -2.14 112.91 112.33 1tv4 h THR 184 Ca 0.14 -2.27 0.00 0.00 0.77 0.00 0.00 66.41 65.05 1tv4 h THR 184 Cb 0.37 2.22 -0.02 0.00 -1.74 0.00 0.00 68.15 68.97 1tv4 h THR 184 CO -0.82 0.65 0.32 0.03 0.37 0.00 0.00 175.52 176.07 1tv4 h ARG 185 N 0.04 0.67 -0.37 6.66 3.08 -1.13 0.91 114.38 124.24 1tv4 h ARG 185 Ca -0.01 -0.05 -0.11 0.00 0.07 0.00 0.00 59.98 59.88 1tv4 h ARG 185 Cb 1.20 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 31.10 1tv4 h ARG 185 CO 0.09 0.47 -0.19 -0.07 -1.07 0.00 0.00 179.97 179.20 1tv4 h LEU 186 N 0.67 0.81 -0.54 3.04 3.38 -0.87 -2.34 115.31 119.47 1tv4 h LEU 186 Ca 0.18 -0.41 -0.03 0.00 0.09 0.00 0.00 57.88 57.71 1tv4 h LEU 186 Cb -0.04 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 1tv4 h LEU 186 CO -0.04 1.04 0.20 0.40 0.09 0.00 0.00 178.44 180.14 1tv4 h ILE 187 N 0.57 1.22 0.00 1.22 2.04 -1.12 -0.23 117.51 121.22 1tv4 h ILE 187 Ca 0.08 -0.71 -0.05 0.00 1.00 0.00 0.00 64.86 65.18 1tv4 h ILE 187 Cb 0.74 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 1tv4 h ILE 187 CO 0.06 0.27 -0.25 0.11 0.00 0.00 0.00 178.15 178.33 1tv4 h LYS 188 N 0.73 0.00 -0.05 2.37 1.57 -0.80 -0.22 116.57 120.17 1tv4 h LYS 188 Ca 0.18 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.79 1tv4 h LYS 188 Cb 0.22 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 1tv4 h LYS 188 CO -0.01 0.25 -0.71 -0.97 -0.57 0.00 0.00 179.45 177.44 1tv4 h ASN 189 N 0.00 0.32 -0.45 0.86 -1.24 -0.81 -1.14 115.58 113.12 1tv4 h ASN 189 Ca -0.00 -0.21 -0.09 0.00 0.71 0.00 0.00 56.30 56.71 1tv4 h ASN 189 Cb 0.60 -0.10 -0.01 0.00 0.73 0.00 0.00 38.32 39.54 1tv4 h ASN 189 CO 0.03 0.93 -0.07 0.00 -1.29 0.00 0.00 177.43 177.03 1tv4 h ALA 190 N 1.06 0.61 -0.81 1.57 0.00 -0.02 -1.45 119.26 120.23 1tv4 h ALA 190 Ca -0.02 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.56 1tv4 h ALA 190 Cb 1.27 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.86 1tv4 h ALA 190 CO 0.11 0.47 0.44 0.00 0.00 0.00 0.00 179.25 180.27 1tv4 h ALA 192 N 1.23 1.01 0.00 0.00 0.00 -0.95 -0.04 119.26 120.51 1tv4 h ALA 192 Ca 0.28 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1tv4 h ALA 192 Cb 0.04 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 1tv4 h ALA 192 CO -0.04 0.61 -0.12 0.52 0.00 0.00 0.00 179.25 180.22 1tv4 h MET 193 N 1.12 0.00 -0.15 0.00 2.86 -0.79 -0.42 114.93 117.55 1tv4 h MET 193 Ca 0.26 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.90 1tv4 h MET 193 Cb 0.18 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.84 1tv4 h MET 193 CO -0.03 0.12 0.00 0.00 1.06 0.00 0.00 176.91 178.06 1tv4 n ALA 194 N -2.26 2.53 -1.04 6.32 0.00 -0.70 -4.90 120.51 120.46 1tv4 n ALA 194 Ca -0.02 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 52.99 1tv4 n ALA 194 Cb 0.25 -1.11 0.00 0.00 0.00 0.00 0.00 19.45 18.59 1tv4 n ALA 194 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tv4 n GLY 195 N 1.03 0.39 2.20 0.00 0.00 -0.17 -4.82 105.19 103.82 1tv4 n GLY 195 Ca 0.15 -1.08 -0.22 0.00 0.00 0.00 0.00 46.02 44.87 1tv4 n GLY 195 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tv4 n ARG 196 N -2.89 0.87 0.11 1.61 1.74 -0.11 -4.98 116.66 113.01 1tv4 n ARG 196 Ca 0.00 -3.33 0.19 0.00 -0.77 0.00 0.00 57.85 53.94 1tv4 n ARG 196 Cb 0.02 -1.43 0.76 0.00 -1.02 0.00 0.00 32.46 30.79 1tv4 n ARG 196 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 1tv4 h PRO 197 N 3.60 0.00 -0.64 5.56 0.11 -1.80 -2.89 132.00 135.94 1tv4 h PRO 197 Ca 0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.19 1tv4 h PRO 197 Cb 0.91 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.02 1tv4 h PRO 197 CO 0.49 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.69 1tv4 n GLY 198 N -1.50 2.16 3.75 -0.55 0.00 -1.26 -4.68 105.19 103.11 1tv4 n GLY 198 Ca 0.06 -0.71 -0.41 0.00 0.00 0.00 0.00 46.02 44.95 1tv4 n GLY 198 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1tv4 n MET 199 N 1.14 2.73 -2.02 1.61 2.81 -1.09 -0.13 117.12 122.17 1tv4 n MET 199 Ca 0.22 0.97 -0.32 0.00 -1.81 0.00 0.00 57.70 56.76 1tv4 n MET 199 Cb 0.67 -2.75 0.00 0.00 -0.71 0.00 0.00 33.22 30.43 1tv4 n MET 199 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1tv4 s GLY 200 N 0.41 1.84 0.42 3.03 0.00 -1.26 -4.78 107.32 106.98 1tv4 s GLY 200 Ca 0.62 0.07 0.03 0.00 0.00 0.00 0.00 44.72 45.44 1tv4 s GLY 200 CO 0.51 0.35 0.09 -1.34 0.00 0.00 0.00 173.10 172.71 1tv4 s VAL 201 N -2.91 0.80 -0.05 1.40 -7.23 -1.26 -1.11 120.40 110.04 1tv4 s VAL 201 Ca 0.57 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.74 1tv4 s VAL 201 Cb -0.12 -2.37 0.03 0.00 0.56 0.00 0.00 36.38 34.48 1tv4 s VAL 201 CO 0.45 0.00 0.01 -0.75 -0.31 0.00 0.00 175.10 174.50 1tv4 s LYS 202 N -3.76 0.43 0.00 4.82 2.36 0.23 -1.22 119.74 122.60 1tv4 s LYS 202 Ca 0.22 0.12 0.00 0.00 -2.55 0.00 0.00 55.97 53.76 1tv4 s LYS 202 Cb 0.03 -0.75 0.00 0.00 -1.05 0.00 0.00 37.83 36.06 1tv4 s LYS 202 CO 0.12 -0.24 0.00 0.41 1.55 0.00 0.00 175.35 177.19 1tv4 n GLY 203 N 4.79 1.18 3.83 5.54 0.00 -0.94 -2.10 105.19 117.50 1tv4 n GLY 203 Ca -0.13 -0.57 -0.32 0.00 0.00 0.00 0.00 46.02 45.00 1tv4 n GLY 203 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1tv4 s PRO 204 N 1.16 3.39 0.00 1.61 0.04 -1.26 -0.91 135.00 139.03 1tv4 s PRO 204 Ca 0.00 0.96 0.00 0.00 0.04 0.00 0.00 61.00 62.00 1tv4 s PRO 204 Cb 0.00 -2.05 0.00 0.00 0.04 0.00 0.00 34.50 32.49 1tv4 s PRO 204 CO 0.00 -0.74 0.00 0.39 0.04 0.00 0.00 177.00 176.69 1tv4 n GLU 205 N -2.49 1.40 0.05 4.56 -0.58 -1.26 -4.79 120.64 117.53 1tv4 n GLU 205 Ca 0.07 0.00 -0.04 0.00 -0.42 0.00 0.00 57.16 56.77 1tv4 n GLU 205 Cb 0.54 -0.95 0.17 0.00 -0.57 0.00 0.00 31.44 30.63 1tv4 n GLU 205 CO 0.00 0.00 0.00 1.15 -0.48 0.00 0.00 177.13 177.80 1tv4 h THR 206 N 0.00 1.31 -4.03 2.62 2.02 -1.91 -3.44 112.91 109.48 1tv4 h THR 206 Ca 0.00 -1.54 -0.46 0.00 0.77 0.00 0.00 66.41 65.19 1tv4 h THR 206 Cb 0.89 1.62 -0.00 0.00 -1.74 0.00 0.00 68.15 68.92 1tv4 h THR 206 CO 0.00 0.47 0.36 -0.94 0.37 0.00 0.00 175.52 175.78 1tv4 s SER 207 N -6.86 6.79 0.00 4.18 1.04 -1.26 -4.97 113.70 112.62 1tv4 s SER 207 Ca -0.06 1.82 0.00 0.00 0.48 0.00 0.00 55.95 58.20 1tv4 s SER 207 Cb 0.13 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.69 1tv4 s SER 207 CO 0.79 -0.46 0.00 0.18 0.98 0.00 0.00 173.24 174.73 1tv4 n LEU 208 N -0.51 0.38 -4.88 2.42 4.77 -1.26 -4.81 117.00 113.10 1tv4 n LEU 208 Ca 0.07 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.75 1tv4 n LEU 208 Cb 0.53 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.65 1tv4 n LEU 208 CO 0.40 0.06 0.70 -0.94 -1.33 0.00 0.00 177.39 176.28 1tv4 s SER 209 N -2.80 5.76 0.15 -1.43 1.04 -1.26 -4.89 113.70 110.27 1tv4 s SER 209 Ca 0.00 1.16 -0.15 0.00 0.48 0.00 0.00 55.95 57.44 1tv4 s SER 209 Cb 0.00 -2.09 0.03 0.00 0.10 0.00 0.00 66.02 64.06 1tv4 s SER 209 CO 0.00 -1.11 1.74 0.00 0.98 0.00 0.00 173.24 174.84 1tv4 h ALA 210 N -0.44 0.60 -0.38 5.32 0.00 -1.98 -0.69 119.26 121.70 1tv4 h ALA 210 Ca -0.45 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.31 1tv4 h ALA 210 Cb 1.23 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 1tv4 h ALA 210 CO 0.63 0.15 0.05 -0.56 0.00 0.00 0.00 179.25 179.52 1tv4 h GLN 211 N 0.61 0.57 -0.14 0.00 3.07 -1.97 -0.22 115.11 117.03 1tv4 h GLN 211 Ca 0.16 -0.11 -0.04 0.00 0.09 0.00 0.00 58.65 58.75 1tv4 h GLN 211 Cb 0.10 -0.09 -0.00 0.00 0.08 0.00 0.00 27.48 27.57 1tv4 h GLN 211 CO -0.02 0.56 -0.08 0.78 0.09 0.00 0.00 178.83 180.16 1tv4 h GLY 212 N 0.83 0.32 1.05 0.06 0.00 -1.82 -2.70 103.07 100.80 1tv4 h GLY 212 Ca 0.12 -0.29 -0.05 0.00 0.00 0.00 0.00 47.33 47.11 1tv4 h GLY 212 CO 0.00 0.27 0.27 3.43 0.00 0.00 0.00 176.54 180.52 1tv4 h ASN 213 N -0.06 1.06 0.51 0.19 2.35 -0.85 -2.69 115.58 116.10 1tv4 h ASN 213 Ca 0.03 -0.19 -0.03 0.00 -0.55 0.00 0.00 56.30 55.56 1tv4 h ASN 213 Cb 0.56 -0.28 -0.00 0.00 0.05 0.00 0.00 38.32 38.65 1tv4 h ASN 213 CO 0.02 0.97 -0.15 0.40 -1.65 0.00 0.00 177.43 177.02 1tv4 h ILE 214 N 1.10 0.55 0.00 2.81 2.04 -1.04 -2.56 117.51 120.41 1tv4 h ILE 214 Ca 0.25 -0.68 0.00 0.00 1.00 0.00 0.00 64.86 65.43 1tv4 h ILE 214 Cb 0.25 1.45 0.00 0.00 -0.74 0.00 0.00 36.82 37.79 1tv4 h ILE 214 CO -0.02 0.14 -0.04 -1.54 0.00 0.00 0.00 178.15 176.70 1tv4 n SER 215 N -3.56 0.06 0.11 1.72 3.41 -1.02 -4.06 113.62 110.29 1tv4 n SER 215 Ca -0.01 0.45 0.04 0.00 -0.26 0.00 0.00 58.87 59.08 1tv4 n SER 215 Cb 0.29 -0.46 0.44 0.00 -0.26 0.00 0.00 64.21 64.22 1tv4 n SER 215 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1tv4 h ALA 216 N 2.98 1.64 -2.13 7.33 0.00 -1.48 -3.42 119.26 124.18 1tv4 h ALA 216 Ca 0.00 -0.13 -0.56 0.00 0.00 0.00 0.00 54.91 54.22 1tv4 h ALA 216 Cb 0.51 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1tv4 h ALA 216 CO 0.00 0.27 1.01 -0.51 0.00 0.00 0.00 179.25 180.03 1tv4 s ASP 217 N -6.86 6.71 0.15 0.00 1.01 -1.26 -3.49 116.67 112.93 1tv4 s ASP 217 Ca -0.06 1.78 -0.24 0.00 0.71 0.00 0.00 52.55 54.73 1tv4 s ASP 217 Cb 0.16 -2.54 0.06 0.00 1.01 0.00 0.00 42.92 41.62 1tv4 s ASP 217 CO 0.72 -0.95 0.77 0.00 0.21 0.00 0.00 175.17 175.92 1tv4 s THR 219 N -3.55 2.22 0.00 0.00 2.01 -1.26 -0.81 115.64 114.25 1tv4 s THR 219 Ca 0.07 0.05 0.00 0.00 0.31 0.00 0.00 61.69 62.11 1tv4 s THR 219 Cb -0.02 -3.03 0.00 0.00 0.01 0.00 0.00 72.50 69.46 1tv4 s THR 219 CO -0.04 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.50 1tv4 n GLY 220 N 4.05 2.70 0.00 4.40 0.00 -1.26 -4.95 105.19 110.14 1tv4 n GLY 220 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1tv4 n GLY 220 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tv4 n GLY 221 N -2.00 2.88 3.77 -0.02 0.00 0.01 -4.09 105.19 105.74 1tv4 n GLY 221 Ca 0.00 -1.44 -0.40 0.00 0.00 0.00 0.00 46.02 44.18 1tv4 n GLY 221 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1tv4 s MET 222 N 4.85 4.16 0.30 1.61 1.00 -1.23 -4.77 119.30 125.22 1tv4 s MET 222 Ca 0.00 2.14 0.07 0.00 0.00 0.00 0.00 55.69 57.90 1tv4 s MET 222 Cb 0.00 -2.90 -0.03 0.00 0.00 0.00 0.00 34.83 31.91 1tv4 s MET 222 CO 0.00 -0.32 0.25 -2.37 0.00 0.00 0.00 175.02 172.58 1tv4 n THR 223 N 0.44 0.00 0.30 2.05 5.66 -1.26 -2.44 114.28 119.02 1tv4 n THR 223 Ca 0.02 -2.16 0.19 0.00 -3.05 0.00 0.00 64.05 59.05 1tv4 n THR 223 Cb 0.43 1.08 1.01 0.00 -1.55 0.00 0.00 70.33 71.30 1tv4 n THR 223 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1tv4 n THR 225 N -2.86 0.60 -4.19 0.00 -2.24 -1.26 -2.88 114.28 101.44 1tv4 n THR 225 Ca -0.02 -0.55 -0.26 0.00 -2.27 0.00 0.00 64.05 60.95 1tv4 n THR 225 Cb 0.09 0.22 -0.07 0.00 -2.10 0.00 0.00 70.33 68.47 1tv4 n THR 225 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1tv4 s ASP 226 N -0.96 4.93 -0.09 3.42 1.01 -0.62 -1.66 116.67 122.69 1tv4 s ASP 226 Ca 0.27 -0.37 -0.28 0.00 0.71 0.00 0.00 52.55 52.88 1tv4 s ASP 226 Cb 0.14 -1.10 -0.02 0.00 1.01 0.00 0.00 42.92 42.96 1tv4 s ASP 226 CO 0.17 0.07 0.93 -0.44 0.21 0.00 0.00 175.17 176.11 1tv4 s SER 227 N -3.12 7.19 -0.27 0.27 0.01 -0.36 -3.89 113.70 113.53 1tv4 s SER 227 Ca 0.29 1.45 -0.09 0.00 1.31 0.00 0.00 55.95 58.91 1tv4 s SER 227 Cb -0.09 -2.52 -0.03 0.00 0.21 0.00 0.00 66.02 63.58 1tv4 s SER 227 CO 0.20 -0.36 0.14 -1.00 0.41 0.00 0.00 173.24 172.62 1tv4 s HIS 228 N 1.69 3.16 0.07 2.43 3.76 0.00 -2.21 115.29 124.19 1tv4 s HIS 228 Ca 0.46 -0.21 -0.25 0.00 -0.15 0.00 0.00 55.06 54.91 1tv4 s HIS 228 Cb -0.18 -2.32 -0.06 0.00 1.11 0.00 0.00 32.58 31.13 1tv4 s HIS 228 CO 0.19 -0.29 0.78 -2.00 -0.85 0.00 0.00 174.74 172.57 1tv4 s GLU 229 N 1.68 4.52 -0.03 1.40 2.12 -0.09 0.36 118.70 128.67 1tv4 s GLU 229 Ca 0.06 1.11 0.01 0.00 0.36 0.00 0.00 54.97 56.51 1tv4 s GLU 229 Cb -0.16 -3.34 0.02 0.00 0.26 0.00 0.00 34.13 30.91 1tv4 s GLU 229 CO 0.07 0.34 -0.01 0.54 -0.54 0.00 0.00 175.26 175.67 1tv4 s VAL 230 N -0.29 0.19 -0.16 3.70 0.11 -0.85 -4.76 120.40 118.35 1tv4 s VAL 230 Ca 0.38 0.05 -0.05 0.00 -2.93 0.00 0.00 61.98 59.43 1tv4 s VAL 230 Cb -0.21 -0.27 -0.03 0.00 -1.53 0.00 0.00 36.38 34.34 1tv4 s VAL 230 CO 0.24 0.13 0.01 -0.44 -3.33 0.00 0.00 175.10 171.71 1tv4 s SER 231 N 0.85 5.18 0.52 3.54 0.01 -1.26 -1.05 113.70 121.49 1tv4 s SER 231 Ca -0.09 -0.02 -0.07 0.00 1.31 0.00 0.00 55.95 57.09 1tv4 s SER 231 Cb -0.12 -1.83 -0.04 0.00 0.21 0.00 0.00 66.02 64.25 1tv4 s SER 231 CO -0.01 0.19 0.86 -1.10 0.41 0.00 0.00 173.24 173.59 1tv4 s GLN 232 N 0.23 3.53 0.34 12.44 -0.21 0.74 -4.87 119.66 131.86 1tv4 s GLN 232 Ca 0.00 0.34 0.05 0.00 0.02 0.00 0.00 55.36 55.78 1tv4 s GLN 232 Cb -0.13 -2.29 0.05 0.00 1.00 0.00 0.00 33.01 31.64 1tv4 s GLN 232 CO 0.02 -0.33 0.45 1.28 -2.12 0.00 0.00 175.29 174.59 1tv4 n LEU 233 N -2.41 0.00 -4.30 2.90 4.77 0.02 -4.72 117.00 113.26 1tv4 n LEU 233 Ca 0.02 -1.48 -0.34 0.00 -0.03 0.00 0.00 56.01 54.18 1tv4 n LEU 233 Cb 0.55 -0.23 -0.14 0.00 -2.33 0.00 0.00 43.42 41.26 1tv4 n LEU 233 CO 0.55 -0.61 -0.41 0.20 -1.33 0.00 0.00 177.39 175.78 1tv4 s ASN 234 N -3.08 4.13 0.05 -1.43 -0.87 -1.26 -3.91 114.94 108.57 1tv4 s ASN 234 Ca 0.34 -0.41 0.08 0.00 -1.57 0.00 0.00 52.86 51.30 1tv4 s ASN 234 Cb -0.03 -1.69 -0.03 0.00 -0.02 0.00 0.00 41.25 39.48 1tv4 s ASN 234 CO 0.22 0.01 -0.21 -1.61 -2.57 0.00 0.00 177.10 172.94 1tv4 s GLU 235 N 1.29 1.41 -1.17 -0.60 0.41 -1.26 -4.84 118.70 113.95 1tv4 s GLU 235 Ca 0.03 -0.97 -0.18 0.00 -0.41 0.00 0.00 54.97 53.45 1tv4 s GLU 235 Cb -0.14 -1.54 -0.01 0.00 -1.78 0.00 0.00 34.13 30.66 1tv4 s GLU 235 CO -0.03 0.39 0.76 1.28 -0.49 0.00 0.00 175.26 177.17 1tv4 n LEU 236 N 1.80 -2.90 -3.85 1.80 4.32 -1.25 -4.84 117.00 112.08 1tv4 n LEU 236 Ca -0.17 -1.00 -0.10 0.00 -0.02 0.00 0.00 56.01 54.72 1tv4 n LEU 236 Cb 0.53 -2.42 -0.08 0.00 -1.62 0.00 0.00 43.42 39.83 1tv4 n LEU 236 CO 0.23 0.45 -0.10 -0.75 -1.22 0.00 0.00 177.39 176.00 1tv4 s LYS 237 N -5.98 0.75 0.10 3.23 2.20 -1.26 -1.71 119.74 117.07 1tv4 s LYS 237 Ca 0.41 -0.76 -0.25 0.00 -0.36 0.00 0.00 55.97 55.00 1tv4 s LYS 237 Cb -0.14 0.31 0.07 0.00 -1.51 0.00 0.00 37.83 36.55 1tv4 s LYS 237 CO 0.86 -0.22 0.63 -1.50 -0.36 0.00 0.00 175.35 174.76 1tv4 s ILE 238 N -3.07 0.00 0.25 5.43 1.10 -0.39 -0.80 121.20 123.72 1tv4 s ILE 238 Ca -0.01 0.00 0.09 0.00 -0.51 0.00 0.00 60.65 60.22 1tv4 s ILE 238 Cb 0.01 -1.00 -0.04 0.00 0.15 0.00 0.00 42.46 41.58 1tv4 s ILE 238 CO -0.07 0.00 -0.01 1.51 -2.11 0.00 0.00 174.94 174.26 1tv4 s ASP 239 N -2.34 4.56 0.53 4.50 -4.77 -1.26 -1.87 116.67 116.02 1tv4 s ASP 239 Ca -0.02 -0.60 0.28 0.00 -3.30 0.00 0.00 52.55 48.91 1tv4 s ASP 239 Cb -0.01 -0.86 1.47 0.00 -1.09 0.00 0.00 42.92 42.43 1tv4 s ASP 239 CO -0.07 0.02 2.08 -0.07 0.70 0.00 0.00 175.17 177.83 1tv4 h LEU 240 N 2.09 0.00 -0.27 2.11 3.38 -1.98 -2.75 115.31 117.89 1tv4 h LEU 240 Ca -0.45 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.56 1tv4 h LEU 240 Cb 1.24 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.96 1tv4 h LEU 240 CO 0.59 0.11 0.07 0.44 0.09 0.00 0.00 178.44 179.74 1tv4 h ASP 241 N 0.00 0.04 -0.67 -0.43 5.19 -2.00 -1.65 116.42 116.89 1tv4 h ASP 241 Ca -0.00 0.04 -0.01 0.00 -0.62 0.00 0.00 57.03 56.44 1tv4 h ASP 241 Cb 0.31 0.05 -0.03 0.00 0.18 0.00 0.00 39.33 39.84 1tv4 h ASP 241 CO 0.01 0.06 0.39 0.00 -3.12 0.00 0.00 179.24 176.58 1tv4 h ALA 242 N 1.19 1.39 -0.83 3.45 0.00 -1.84 -1.49 119.26 121.13 1tv4 h ALA 242 Ca 0.12 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1tv4 h ALA 242 Cb 0.12 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 1tv4 h ALA 242 CO -0.15 0.51 0.37 0.82 0.00 0.00 0.00 179.25 180.79 1tv4 h ILE 243 N 0.95 1.26 -0.12 0.00 1.08 -1.32 -0.37 117.51 118.99 1tv4 h ILE 243 Ca 0.24 -0.78 -0.16 0.00 -0.39 0.00 0.00 64.86 63.77 1tv4 h ILE 243 Cb 0.00 0.23 -0.01 0.00 -3.07 0.00 0.00 36.82 33.98 1tv4 h ILE 243 CO -0.04 0.33 -0.62 0.28 -0.69 0.00 0.00 178.15 177.41 1tv4 h SER 244 N 1.20 0.49 -0.53 1.72 0.02 -0.85 -2.54 113.55 113.07 1tv4 h SER 244 Ca 0.28 -0.29 -0.06 0.00 -0.84 0.00 0.00 61.79 60.88 1tv4 h SER 244 Cb 0.17 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 62.54 1tv4 h SER 244 CO -0.03 0.99 0.11 0.58 -1.14 0.00 0.00 176.83 177.34 1tv4 h VAL 245 N 0.32 1.24 -0.35 2.27 2.07 -0.86 -1.82 116.25 119.12 1tv4 h VAL 245 Ca -0.01 -0.91 -0.02 0.00 0.82 0.00 0.00 66.70 66.58 1tv4 h VAL 245 Cb 1.16 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 31.60 1tv4 h VAL 245 CO 0.11 0.34 0.14 0.40 0.02 0.00 0.00 177.57 178.58 1tv4 h ILE 246 N 0.87 1.19 -0.91 4.57 2.04 -0.93 -0.97 117.51 123.36 1tv4 h ILE 246 Ca 0.18 -0.58 0.08 0.00 1.00 0.00 0.00 64.86 65.54 1tv4 h ILE 246 Cb 0.36 0.91 -0.06 0.00 -0.74 0.00 0.00 36.82 37.28 1tv4 h ILE 246 CO 0.00 0.20 0.59 0.00 0.00 0.00 0.00 178.15 178.95 1tv4 h ALA 247 N 0.99 1.54 -0.10 1.87 0.00 -1.08 -0.73 119.26 121.74 1tv4 h ALA 247 Ca 0.12 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1tv4 h ALA 247 Cb 0.18 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1tv4 h ALA 247 CO -0.01 0.31 -0.01 1.25 0.00 0.00 0.00 179.25 180.79 1tv4 h HIS 248 N 1.00 0.20 -0.58 0.00 -0.00 -0.86 -1.28 115.15 113.63 1tv4 h HIS 248 Ca 0.40 -0.04 0.01 0.00 -0.00 0.00 0.00 60.37 60.74 1tv4 h HIS 248 Cb 0.27 -0.05 -0.03 0.00 -0.00 0.00 0.00 27.41 27.60 1tv4 h HIS 248 CO -0.00 0.47 0.38 1.88 -0.00 0.00 0.00 177.93 180.66 1tv4 h TYR 249 N -0.12 0.73 -0.70 5.26 0.99 -0.70 -2.23 116.97 120.19 1tv4 h TYR 249 Ca 0.03 0.02 -0.04 0.00 2.00 0.00 0.00 58.73 60.73 1tv4 h TYR 249 Cb 0.40 -0.25 -0.03 0.00 1.00 0.00 0.00 36.73 37.85 1tv4 h TYR 249 CO 0.04 0.46 0.27 0.87 -0.00 0.00 0.00 178.16 179.80 1tv4 h LYS 250 N 0.78 1.06 0.00 4.88 1.57 -1.14 -1.42 116.57 122.30 1tv4 h LYS 250 Ca 0.21 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1tv4 h LYS 250 Cb -0.09 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.05 1tv4 h LYS 250 CO -0.05 0.88 0.00 0.78 -0.57 0.00 0.00 179.45 180.49 1tv4 h GLY 251 N 1.01 0.00 -1.57 3.86 0.00 -0.75 -2.20 103.07 103.41 1tv4 h GLY 251 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.56 1tv4 h GLY 251 CO -0.02 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.22 1tv4 n ASN 252 N -2.53 2.79 -3.22 0.19 4.13 -0.88 -4.97 115.26 110.75 1tv4 n ASN 252 Ca 0.00 -1.82 -0.23 0.00 1.68 0.00 0.00 54.58 54.22 1tv4 n ASN 252 Cb 0.19 -0.14 0.05 0.00 -1.54 0.00 0.00 39.78 38.34 1tv4 n ASN 252 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 1tv4 n SER 253 N 0.97 -6.20 -4.82 6.41 2.88 -0.83 -4.81 113.62 107.22 1tv4 n SER 253 Ca 0.13 -0.38 -0.35 0.00 -1.33 0.00 0.00 58.87 56.94 1tv4 n SER 253 Cb 0.46 -4.97 -0.06 0.00 -0.75 0.00 0.00 64.21 58.89 1tv4 n SER 253 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 1tv4 s ASP 254 N -2.91 6.99 0.05 -3.46 1.01 -0.57 -4.79 116.67 112.98 1tv4 s ASP 254 Ca 0.40 1.46 -0.31 0.00 0.71 0.00 0.00 52.55 54.82 1tv4 s ASP 254 Cb -0.18 -2.44 -0.06 0.00 1.01 0.00 0.00 42.92 41.25 1tv4 s ASP 254 CO 0.50 -0.11 1.39 -0.63 0.21 0.00 0.00 175.17 176.53 1tv4 s ILE 255 N -1.77 3.57 -0.20 0.77 -1.09 -1.14 -4.75 121.20 116.59 1tv4 s ILE 255 Ca 0.50 1.05 -0.07 0.00 -2.23 0.00 0.00 60.65 59.90 1tv4 s ILE 255 Cb -0.14 -3.67 -0.03 0.00 -1.58 0.00 0.00 42.46 37.04 1tv4 s ILE 255 CO 0.19 0.04 0.05 -0.63 -1.23 0.00 0.00 174.94 173.35 1tv4 s ILE 256 N 1.82 4.45 -0.36 2.92 1.01 -1.26 -0.82 121.20 128.96 1tv4 s ILE 256 Ca 0.64 -0.15 -0.02 0.00 0.00 0.00 0.00 60.65 61.12 1tv4 s ILE 256 Cb -0.33 -3.02 0.08 0.00 0.01 0.00 0.00 42.46 39.20 1tv4 s ILE 256 CO 0.28 0.42 0.11 -0.32 0.00 0.00 0.00 174.94 175.44 1tv4 s MET 257 N 0.81 2.19 0.10 2.79 -2.45 0.16 0.14 119.30 123.03 1tv4 s MET 257 Ca 0.03 -1.57 -0.25 0.00 -1.25 0.00 0.00 55.69 52.65 1tv4 s MET 257 Cb -0.14 -3.41 -0.07 0.00 1.25 0.00 0.00 34.83 32.47 1tv4 s MET 257 CO 0.02 -0.87 0.76 0.34 1.05 0.00 0.00 175.02 176.33 1tv4 s ASP 258 N 1.54 7.28 0.06 1.11 2.15 -0.72 -2.01 116.67 126.08 1tv4 s ASP 258 Ca 0.03 1.52 0.06 0.00 0.43 0.00 0.00 52.55 54.59 1tv4 s ASP 258 Cb -0.21 -2.48 -0.03 0.00 -0.30 0.00 0.00 42.92 39.90 1tv4 s ASP 258 CO -0.03 0.11 -0.17 -0.70 -0.17 0.00 0.00 175.17 174.21 1tv4 s GLU 259 N -0.56 1.05 -0.22 4.34 2.12 -0.22 0.19 118.70 125.40 1tv4 s GLU 259 Ca 0.37 -0.93 -0.15 0.00 0.36 0.00 0.00 54.97 54.62 1tv4 s GLU 259 Cb -0.22 -1.14 0.06 0.00 0.26 0.00 0.00 34.13 33.10 1tv4 s GLU 259 CO 0.24 0.27 0.55 -1.14 -0.54 0.00 0.00 175.26 174.64 1tv4 s GLN 260 N -1.45 0.58 -0.57 4.30 -0.44 -0.72 -0.18 119.66 121.18 1tv4 s GLN 260 Ca 0.03 0.92 0.04 0.00 -2.50 0.00 0.00 55.36 53.85 1tv4 s GLN 260 Cb -0.09 0.15 0.14 0.00 -1.64 0.00 0.00 33.01 31.57 1tv4 s GLN 260 CO 0.02 -0.13 0.32 -1.64 0.50 0.00 0.00 175.29 174.37 1tv4 s MET 261 N 1.07 2.11 0.34 1.67 -1.94 -1.26 -3.27 119.30 118.02 1tv4 s MET 261 Ca -0.06 -2.80 -0.29 0.00 -1.71 0.00 0.00 55.69 50.83 1tv4 s MET 261 Cb -0.06 -3.36 -0.11 0.00 2.01 0.00 0.00 34.83 33.32 1tv4 s MET 261 CO -0.10 -1.15 1.46 -1.25 -0.01 0.00 0.00 175.02 173.97 1tv4 s PRO 262 N -0.57 4.18 -0.31 2.03 0.04 -1.26 -4.67 135.00 134.44 1tv4 s PRO 262 Ca 0.19 2.47 -0.13 0.00 0.04 0.00 0.00 61.00 63.56 1tv4 s PRO 262 Cb -0.21 -3.01 -0.03 0.00 0.04 0.00 0.00 34.50 31.29 1tv4 s PRO 262 CO -0.04 -0.46 0.28 0.42 0.04 0.00 0.00 177.00 177.24 1tv4 s ILE 263 N -0.82 5.24 0.08 0.56 1.01 -1.26 -1.25 121.20 124.77 1tv4 s ILE 263 Ca 0.54 0.08 -0.31 0.00 0.00 0.00 0.00 60.65 60.97 1tv4 s ILE 263 Cb -0.45 -3.69 -0.07 0.00 0.01 0.00 0.00 42.46 38.26 1tv4 s ILE 263 CO 0.56 0.07 1.43 0.12 0.00 0.00 0.00 174.94 177.12 1tv4 s PHE 264 N 1.87 3.05 0.00 3.97 5.36 0.30 -0.98 117.98 131.55 1tv4 s PHE 264 Ca 0.09 0.84 0.00 0.00 -0.96 0.00 0.00 56.93 56.90 1tv4 s PHE 264 Cb -0.17 -3.72 0.00 0.00 -0.34 0.00 0.00 43.02 38.80 1tv4 s PHE 264 CO 0.11 -2.59 0.00 0.41 -1.46 0.00 0.00 175.22 171.69 1tv4 n GLY 265 N 3.59 0.69 0.00 13.12 0.00 0.13 -1.55 105.19 121.18 1tv4 n GLY 265 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1tv4 n GLY 265 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tv4 n GLY 266 N -2.56 1.18 0.27 -0.02 0.00 -0.15 -4.79 105.19 99.12 1tv4 n GLY 266 Ca 0.00 -1.59 0.11 0.00 0.00 0.00 0.00 46.02 44.54 1tv4 n GLY 266 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1tv4 h TYR 267 N 0.00 0.00 0.05 1.61 0.05 -1.86 -2.83 116.97 113.99 1tv4 h TYR 267 Ca 0.00 0.00 -0.27 0.00 0.05 0.00 0.00 58.73 58.51 1tv4 h TYR 267 Cb 0.00 0.00 0.02 0.00 1.01 0.00 0.00 36.73 37.76 1tv4 h TYR 267 CO 0.00 0.05 -1.10 0.00 -1.05 0.00 0.00 178.16 176.06 1tv4 h ALA 268 N 1.95 0.14 0.00 3.88 0.00 -1.87 -3.26 119.26 120.10 1tv4 h ALA 268 Ca -0.00 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 54.18 1tv4 h ALA 268 Cb 0.11 0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1tv4 h ALA 268 CO 0.01 0.73 0.00 0.41 0.00 0.00 0.00 179.25 180.40 1tv4 n GLY 269 N 1.17 0.13 0.00 0.00 0.00 -1.07 -4.67 105.19 100.76 1tv4 n GLY 269 Ca -0.11 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.26 1tv4 n GLY 269 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tv4 n GLY 270 N 0.00 -0.01 0.33 -0.02 0.00 -1.26 -0.69 105.19 103.54 1tv4 n GLY 270 Ca 0.00 -1.57 -0.12 0.00 0.00 0.00 0.00 46.02 44.33 1tv4 n GLY 270 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1tv4 h ILE 271 N 0.00 0.00 -0.85 -0.61 2.04 -1.98 0.42 117.51 116.53 1tv4 h ILE 271 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1tv4 h ILE 271 Cb 0.00 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.04 1tv4 h ILE 271 CO 0.00 0.00 0.54 -0.33 0.00 0.00 0.00 178.15 178.36 1tv4 h GLU 272 N -0.70 1.13 -0.12 2.37 3.07 -1.95 -0.93 114.58 117.45 1tv4 h GLU 272 Ca -0.05 -0.08 -0.01 0.00 -0.50 0.00 0.00 59.36 58.72 1tv4 h GLU 272 Cb 0.59 -0.25 -0.01 0.00 -0.84 0.00 0.00 28.75 28.25 1tv4 h GLU 272 CO 0.00 0.77 0.05 0.93 -1.40 0.00 0.00 179.01 179.36 1tv4 h GLU 273 N 1.16 0.18 0.00 2.33 3.07 -1.86 -1.49 114.58 117.97 1tv4 h GLU 273 Ca 0.31 -0.03 -0.05 0.00 -0.50 0.00 0.00 59.36 59.09 1tv4 h GLU 273 Cb -0.10 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 27.78 1tv4 h GLU 273 CO -0.06 0.28 -0.23 1.15 -1.40 0.00 0.00 179.01 178.75 1tv4 h THR 274 N 0.04 0.79 0.00 1.13 2.02 -0.66 -2.47 112.91 113.76 1tv4 h THR 274 Ca 0.04 -0.93 -0.20 0.00 0.77 0.00 0.00 66.41 66.09 1tv4 h THR 274 Cb 0.17 1.57 -0.01 0.00 -1.74 0.00 0.00 68.15 68.14 1tv4 h THR 274 CO -0.00 0.23 -0.87 0.74 0.37 0.00 0.00 175.52 175.98 1tv4 h THR 275 N 0.00 1.49 -0.54 3.16 2.02 -0.85 -1.00 112.91 117.19 1tv4 h THR 275 Ca -0.00 -2.59 -0.05 0.00 0.77 0.00 0.00 66.41 64.53 1tv4 h THR 275 Cb 0.55 2.45 -0.02 0.00 -1.74 0.00 0.00 68.15 69.39 1tv4 h THR 275 CO 0.03 0.76 0.15 0.40 0.37 0.00 0.00 175.52 177.23 1tv4 h ILE 276 N 0.11 1.24 -0.53 3.11 2.04 -0.84 -0.89 117.51 121.75 1tv4 h ILE 276 Ca -0.04 -0.84 -0.02 0.00 1.00 0.00 0.00 64.86 64.96 1tv4 h ILE 276 Cb 1.50 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 38.30 1tv4 h ILE 276 CO 0.13 0.31 0.26 0.58 0.00 0.00 0.00 178.15 179.43 1tv4 h VAL 277 N 0.76 1.20 -0.50 1.67 2.07 -1.36 -1.53 116.25 118.56 1tv4 h VAL 277 Ca 0.17 -0.54 0.02 0.00 0.82 0.00 0.00 66.70 67.17 1tv4 h VAL 277 Cb 0.31 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 1tv4 h VAL 277 CO -0.00 0.22 0.30 -0.78 0.02 0.00 0.00 177.57 177.33 1tv4 h ASP 278 N 0.71 0.49 -0.83 0.57 1.82 -0.75 0.79 116.42 119.22 1tv4 h ASP 278 Ca 0.18 0.00 -0.04 0.00 -0.39 0.00 0.00 57.03 56.79 1tv4 h ASP 278 Cb 0.11 -0.10 -0.04 0.00 0.68 0.00 0.00 39.33 39.98 1tv4 h ASP 278 CO -0.02 0.35 0.37 0.58 -1.61 0.00 0.00 179.24 178.91 1tv4 h VAL 279 N 0.60 1.26 -0.54 2.25 2.07 -0.96 -1.47 116.25 119.46 1tv4 h VAL 279 Ca 0.20 -0.77 -0.06 0.00 0.82 0.00 0.00 66.70 66.88 1tv4 h VAL 279 Cb 0.01 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 29.97 1tv4 h VAL 279 CO -0.08 0.33 0.09 0.00 0.02 0.00 0.00 177.57 177.92 1tv4 h ALA 280 N 1.20 1.14 0.00 1.67 0.00 -0.39 -2.40 119.26 120.48 1tv4 h ALA 280 Ca 0.28 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1tv4 h ALA 280 Cb 0.16 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1tv4 h ALA 280 CO -0.03 0.57 -0.20 1.79 0.00 0.00 0.00 179.25 181.38 1tv4 h THR 281 N 0.82 0.37 -0.32 0.00 1.35 -0.45 -0.36 112.91 114.32 1tv4 h THR 281 Ca 0.17 -1.40 -0.13 0.00 -0.55 0.00 0.00 66.41 64.50 1tv4 h THR 281 Cb 0.36 2.08 -0.00 0.00 -1.73 0.00 0.00 68.15 68.85 1tv4 h THR 281 CO 0.01 0.20 -0.32 0.45 -0.25 0.00 0.00 175.52 175.61 1tv4 h HIS 282 N 0.00 0.94 -0.33 4.73 3.86 -1.00 -1.92 115.15 121.43 1tv4 h HIS 282 Ca -0.00 -0.28 -0.12 0.00 -1.16 0.00 0.00 60.37 58.80 1tv4 h HIS 282 Cb 1.06 -0.20 -0.01 0.00 1.06 0.00 0.00 27.41 29.33 1tv4 h HIS 282 CO 0.00 1.06 -0.28 0.82 0.86 0.00 0.00 177.93 180.39 1tv4 h ILE 283 N 0.56 1.29 -0.06 2.45 2.04 -1.28 -2.91 117.51 119.59 1tv4 h ILE 283 Ca 0.05 -1.44 -0.00 0.00 1.00 0.00 0.00 64.86 64.47 1tv4 h ILE 283 Cb 0.90 1.47 -0.00 0.00 -0.74 0.00 0.00 36.82 38.44 1tv4 h ILE 283 CO 0.08 0.47 0.03 -1.13 0.00 0.00 0.00 178.15 177.60 1tv4 h ASN 284 N 0.55 0.07 -0.67 1.72 -1.24 -0.97 -2.59 115.58 112.45 1tv4 h ASN 284 Ca 0.06 -0.00 0.08 0.00 0.71 0.00 0.00 56.30 57.14 1tv4 h ASN 284 Cb 0.85 -0.02 -0.06 0.00 0.73 0.00 0.00 38.32 39.81 1tv4 h ASN 284 CO 0.07 0.07 0.34 0.00 -1.29 0.00 0.00 177.43 176.61 1tv4 h ALA 285 N 1.95 0.90 -0.00 1.57 0.00 -1.13 0.13 119.26 122.67 1tv4 h ALA 285 Ca 0.02 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1tv4 h ALA 285 Cb 0.01 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1tv4 h ALA 285 CO -0.00 -0.03 -0.13 1.33 0.00 0.00 0.00 179.25 180.41 1tv4 n VAL 286 N -4.85 0.00 -0.06 0.00 0.24 -0.99 -1.97 118.33 110.70 1tv4 n VAL 286 Ca 0.09 -0.08 -0.06 0.00 -2.04 0.00 0.00 64.34 62.25 1tv4 n VAL 286 Cb 0.23 0.03 -0.02 0.00 -1.47 0.00 0.00 33.84 32.60 1tv4 n VAL 286 CO 0.00 0.00 0.00 -0.11 -2.14 0.00 0.00 176.83 174.58 1tv4 n LEU 287 N -0.83 1.38 0.01 1.34 7.94 -0.64 -4.11 117.00 122.08 1tv4 n LEU 287 Ca 0.14 0.24 -0.18 0.00 -1.11 0.00 0.00 56.01 55.10 1tv4 n LEU 287 Cb 0.29 -0.67 -0.10 0.00 0.53 0.00 0.00 43.42 43.47 1tv4 n LEU 287 CO 0.24 -0.34 0.20 -0.03 -1.11 0.00 0.00 177.39 176.35 1tv4 h MET 288 N -0.71 0.62 -0.04 1.96 4.05 -0.96 -3.36 114.93 116.48 1tv4 h MET 288 Ca 0.00 -0.60 0.00 0.00 -0.28 0.00 0.00 59.70 58.82 1tv4 h MET 288 Cb 0.71 0.16 0.00 0.00 -0.80 0.00 0.00 31.60 31.66 1tv4 h MET 288 CO 0.00 1.21 0.00 0.43 0.23 0.00 0.00 176.91 178.78 1tv4 n SER 289 N -4.03 2.79 -3.61 1.39 7.64 -1.10 -3.78 113.62 112.92 1tv4 n SER 289 Ca -0.10 -1.93 -0.27 0.00 1.01 0.00 0.00 58.87 57.59 1tv4 n SER 289 Cb 0.76 -0.01 -0.00 0.00 -1.01 0.00 0.00 64.21 63.94 1tv4 n SER 289 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1tv4 n SER 290 N 1.18 -3.81 -4.75 6.43 7.64 -1.11 -4.86 113.62 114.34 1tv4 n SER 290 Ca 0.15 -0.57 -0.38 0.00 1.01 0.00 0.00 58.87 59.08 1tv4 n SER 290 Cb 0.56 -3.13 0.05 0.00 -1.01 0.00 0.00 64.21 60.68 1tv4 n SER 290 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1tv4 s ALA 291 N -3.05 2.73 -0.05 -0.43 0.00 -0.83 -4.80 121.76 115.33 1tv4 s ALA 291 Ca 0.51 1.32 -0.06 0.00 0.00 0.00 0.00 51.96 53.72 1tv4 s ALA 291 Cb -0.27 -3.57 -0.28 0.00 0.00 0.00 0.00 23.12 19.00 1tv4 s ALA 291 CO 0.63 -1.43 0.66 0.77 0.00 0.00 0.00 175.76 176.39 1tv4 h SER 292 N 1.27 0.47 -5.08 0.00 0.02 -0.64 -3.43 113.55 106.16 1tv4 h SER 292 Ca -0.51 -0.76 -0.06 0.00 -0.84 0.00 0.00 61.79 59.63 1tv4 h SER 292 Cb 1.31 -0.15 -0.13 0.00 0.14 0.00 0.00 62.40 63.56 1tv4 h SER 292 CO 0.56 1.65 -0.12 -1.66 -1.14 0.00 0.00 176.83 176.12 1tv4 s TRP 293 N -2.59 -0.16 -0.08 3.45 1.48 -0.92 -4.46 118.94 115.67 1tv4 s TRP 293 Ca -0.14 -0.16 0.04 0.00 -1.06 0.00 0.00 56.10 54.78 1tv4 s TRP 293 Cb 0.06 0.21 -0.01 0.00 -1.16 0.00 0.00 33.47 32.57 1tv4 s TRP 293 CO 0.84 -0.67 -0.20 -1.58 -4.06 0.00 0.00 176.95 171.28 1tv4 s HIS 294 N -3.72 2.60 -0.28 1.66 2.46 -0.35 -1.76 115.29 115.89 1tv4 s HIS 294 Ca 0.03 -0.61 -0.09 0.00 0.47 0.00 0.00 55.06 54.85 1tv4 s HIS 294 Cb 0.02 -1.68 -0.03 0.00 -0.13 0.00 0.00 32.58 30.77 1tv4 s HIS 294 CO -0.11 -0.15 0.14 -1.17 -2.47 0.00 0.00 174.74 170.98 1tv4 s LEU 295 N -0.11 3.88 0.76 8.88 2.96 0.13 -1.08 118.68 134.09 1tv4 s LEU 295 Ca -0.04 -0.27 -0.01 0.00 -0.22 0.00 0.00 54.13 53.59 1tv4 s LEU 295 Cb -0.14 -2.02 0.15 0.00 0.50 0.00 0.00 46.19 44.68 1tv4 s LEU 295 CO 0.04 -0.10 1.04 -0.62 -1.32 0.00 0.00 176.35 175.39 1tv4 s ASP 296 N 1.66 4.14 0.00 3.68 -1.08 -0.03 -1.75 116.67 123.29 1tv4 s ASP 296 Ca 0.06 -0.43 0.00 0.00 -0.52 0.00 0.00 52.55 51.66 1tv4 s ASP 296 Cb -0.16 0.15 0.00 0.00 -1.46 0.00 0.00 42.92 41.45 1tv4 s ASP 296 CO 0.07 -2.02 0.00 0.61 0.52 0.00 0.00 175.17 174.35 1tv4 n GLY 297 N -2.94 -1.64 3.68 2.66 0.00 -1.20 -2.15 105.19 103.59 1tv4 n GLY 297 Ca 0.16 0.70 -0.45 0.00 0.00 0.00 0.00 46.02 46.43 1tv4 n GLY 297 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1tv4 n PRO 298 N 0.00 2.30 -4.70 1.61 -0.02 -1.26 -4.22 135.00 128.71 1tv4 n PRO 298 Ca 0.00 0.83 -0.25 0.00 -2.02 0.00 0.00 63.50 62.06 1tv4 n PRO 298 Cb 0.00 -2.62 -0.14 0.00 -0.02 0.00 0.00 33.50 30.72 1tv4 n PRO 298 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1tv4 s VAL 299 N 1.03 1.54 -0.09 -1.45 0.11 -0.38 -4.16 120.40 117.01 1tv4 s VAL 299 Ca 0.78 -1.05 -0.30 0.00 -2.93 0.00 0.00 61.98 58.49 1tv4 s VAL 299 Cb -0.64 -1.33 -0.03 0.00 -1.53 0.00 0.00 36.38 32.86 1tv4 s VAL 299 CO 0.37 0.25 1.21 -2.28 -3.33 0.00 0.00 175.10 171.32 1tv4 s HIS 300 N -0.69 3.10 0.46 1.54 2.46 -0.69 -0.54 115.29 120.94 1tv4 s HIS 300 Ca 0.07 1.17 0.21 0.00 0.47 0.00 0.00 55.06 56.98 1tv4 s HIS 300 Cb -0.08 -3.44 1.21 0.00 -0.13 0.00 0.00 32.58 30.14 1tv4 s HIS 300 CO 0.01 -1.38 1.89 0.97 -2.47 0.00 0.00 174.74 173.76 1tv4 h ILE 301 N 5.17 0.67 0.00 0.89 2.10 -1.62 0.17 117.51 124.90 1tv4 h ILE 301 Ca -0.31 -0.09 -0.18 0.00 1.08 0.00 0.00 64.86 65.35 1tv4 h ILE 301 Cb 1.14 0.39 -0.03 0.00 -1.09 0.00 0.00 36.82 37.23 1tv4 h ILE 301 CO 0.91 0.05 -1.17 -1.14 -1.08 0.00 0.00 178.15 175.72 1tv4 n ARG 302 N -4.44 0.53 0.19 2.19 0.63 -1.26 -4.55 116.66 109.97 1tv4 n ARG 302 Ca 0.17 0.52 0.09 0.00 -0.92 0.00 0.00 57.85 57.71 1tv4 n ARG 302 Cb 0.72 -1.70 0.17 0.00 0.45 0.00 0.00 32.46 32.11 1tv4 n ARG 302 CO 0.00 0.00 0.00 -1.49 -2.51 0.00 0.00 177.63 173.63 1tv4 h TRP 303 N -1.00 0.00 -0.96 -0.14 -0.00 -1.96 -3.47 115.95 108.41 1tv4 h TRP 303 Ca -0.28 0.00 -0.27 0.00 -0.00 0.00 0.00 58.89 58.34 1tv4 h TRP 303 Cb 1.11 0.00 -0.08 0.00 -0.00 0.00 0.00 29.16 30.18 1tv4 h TRP 303 CO -0.03 0.21 -0.27 0.41 -0.00 0.00 0.00 178.44 178.76 1tv4 n GLY 304 N 0.99 0.99 3.60 1.49 0.00 0.60 -4.94 105.19 107.91 1tv4 n GLY 304 Ca 0.03 -0.39 -0.27 0.00 0.00 0.00 0.00 46.02 45.39 1tv4 n GLY 304 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1tv4 s SER 305 N -2.74 4.41 0.00 1.61 0.15 -1.26 -4.80 113.70 111.07 1tv4 s SER 305 Ca 0.00 -0.51 0.24 0.00 0.70 0.00 0.00 55.95 56.38 1tv4 s SER 305 Cb 0.00 -0.81 0.33 0.00 -1.71 0.00 0.00 66.02 63.82 1tv4 s SER 305 CO 0.00 0.11 1.31 0.35 1.20 0.00 0.00 173.24 176.21 1tv4 n THR 306 N 0.06 0.00 -1.49 6.45 -2.24 -0.95 -1.70 114.28 114.42 1tv4 n THR 306 Ca -0.11 -0.29 -0.05 0.00 -2.27 0.00 0.00 64.05 61.33 1tv4 n THR 306 Cb 0.55 1.06 0.19 0.00 -2.10 0.00 0.00 70.33 70.03 1tv4 n THR 306 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1tv4 n ASN 307 N 0.23 2.50 -4.90 3.42 6.94 -1.26 -4.15 115.26 118.03 1tv4 n ASN 307 Ca 0.12 -3.81 -0.28 0.00 -0.02 0.00 0.00 54.58 50.59 1tv4 n ASN 307 Cb 0.47 -0.63 0.04 0.00 -2.36 0.00 0.00 39.78 37.30 1tv4 n ASN 307 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1tv4 s THR 308 N -3.31 3.42 0.21 5.53 -4.23 -1.26 -4.83 115.64 111.17 1tv4 s THR 308 Ca 0.45 0.19 -0.09 0.00 -1.18 0.00 0.00 61.69 61.05 1tv4 s THR 308 Cb 0.41 -3.41 0.16 0.00 1.34 0.00 0.00 72.50 70.99 1tv4 s THR 308 CO -0.01 -0.48 1.73 -0.09 -0.54 0.00 0.00 174.62 175.23 1tv4 h ARG 309 N -0.45 0.35 -0.30 3.99 2.43 -1.95 -1.09 114.38 117.37 1tv4 h ARG 309 Ca -0.45 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 58.65 1tv4 h ARG 309 Cb 1.26 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.72 1tv4 h ARG 309 CO 0.62 0.23 0.02 0.93 -1.51 0.00 0.00 179.97 180.27 1tv4 h GLU 310 N 0.37 0.52 0.00 0.20 3.07 -1.98 -2.32 114.58 114.44 1tv4 h GLU 310 Ca 0.32 -0.15 -0.08 0.00 -0.50 0.00 0.00 59.36 58.94 1tv4 h GLU 310 Cb 0.43 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.28 1tv4 h GLU 310 CO -0.35 0.64 -0.40 1.79 -1.40 0.00 0.00 179.01 179.29 1tv4 h THR 311 N 0.33 1.24 -0.18 1.13 1.35 -1.77 -0.82 112.91 114.19 1tv4 h THR 311 Ca 0.09 -1.40 -0.19 0.00 -0.55 0.00 0.00 66.41 64.36 1tv4 h THR 311 Cb 0.39 1.77 0.00 0.00 -1.73 0.00 0.00 68.15 68.58 1tv4 h THR 311 CO 0.01 0.40 -0.66 -0.07 -0.25 0.00 0.00 175.52 174.95 1tv4 h LEU 312 N 0.00 0.78 -0.55 3.87 3.38 -1.15 -1.84 115.31 119.81 1tv4 h LEU 312 Ca -0.00 -0.46 -0.09 0.00 0.09 0.00 0.00 57.88 57.42 1tv4 h LEU 312 Cb 0.73 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 1tv4 h LEU 312 CO 0.05 1.23 0.01 0.24 0.09 0.00 0.00 178.44 180.06 1tv4 h MET 313 N 0.49 0.96 -0.13 1.13 2.86 -1.04 0.14 114.93 119.35 1tv4 h MET 313 Ca -0.02 -0.30 -0.00 0.00 -2.06 0.00 0.00 59.70 57.32 1tv4 h MET 313 Cb 1.25 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.81 1tv4 h MET 313 CO 0.13 0.96 0.07 0.82 1.06 0.00 0.00 176.91 179.95 1tv4 h ILE 314 N 0.84 1.09 -0.30 -1.22 2.04 -1.08 -1.23 117.51 117.66 1tv4 h ILE 314 Ca 0.16 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.74 1tv4 h ILE 314 Cb 0.52 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.63 1tv4 h ILE 314 CO 0.03 0.09 0.13 0.00 0.00 0.00 0.00 178.15 178.39 1tv4 h ALA 315 N 0.96 0.38 -0.24 1.87 0.00 -1.19 -0.99 119.26 120.05 1tv4 h ALA 315 Ca 0.04 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.87 1tv4 h ALA 315 Cb 0.08 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1tv4 h ALA 315 CO -0.01 -0.04 0.07 0.78 0.00 0.00 0.00 179.25 180.06 1tv4 h GLY 316 N 0.34 0.29 0.89 0.00 0.00 -0.58 -0.56 103.07 103.44 1tv4 h GLY 316 Ca 0.10 -0.04 -0.09 0.00 0.00 0.00 0.00 47.33 47.30 1tv4 h GLY 316 CO -0.01 0.02 -0.17 1.49 0.00 0.00 0.00 176.54 177.87 1tv4 h TRP 317 N 0.18 0.68 -0.09 5.60 4.06 -1.17 -1.48 115.95 123.72 1tv4 h TRP 317 Ca 0.11 -0.18 0.00 0.00 2.06 0.00 0.00 58.89 60.88 1tv4 h TRP 317 Cb 0.09 -0.15 -0.01 0.00 -1.00 0.00 0.00 29.16 28.09 1tv4 h TRP 317 CO -0.13 0.85 0.05 0.00 -3.56 0.00 0.00 178.44 175.65 1tv4 h ALA 318 N 0.72 0.11 -0.11 1.49 0.00 -1.06 -1.28 119.26 119.13 1tv4 h ALA 318 Ca 0.05 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1tv4 h ALA 318 Cb 0.70 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.47 1tv4 h ALA 318 CO 0.05 -0.41 0.00 0.00 0.00 0.00 0.00 179.25 178.89 1tv4 h ALA 320 N 0.75 1.53 -0.16 0.00 0.00 -1.16 0.27 119.26 120.49 1tv4 h ALA 320 Ca 0.03 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.77 1tv4 h ALA 320 Cb 0.35 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1tv4 h ALA 320 CO 0.01 0.33 -0.49 1.15 0.00 0.00 0.00 179.25 180.24 1tv4 h THR 321 N 1.00 1.33 -0.45 0.00 2.02 -1.06 -1.60 112.91 114.16 1tv4 h THR 321 Ca 0.39 -1.75 -0.05 0.00 0.77 0.00 0.00 66.41 65.77 1tv4 h THR 321 Cb 0.23 2.00 -0.02 0.00 -1.74 0.00 0.00 68.15 68.61 1tv4 h THR 321 CO -0.15 0.54 0.07 0.40 0.37 0.00 0.00 175.52 176.75 1tv4 h ILE 322 N 0.27 1.21 -0.37 3.11 1.08 -0.30 -2.12 117.51 120.39 1tv4 h ILE 322 Ca -0.02 -0.81 -0.13 0.00 -0.39 0.00 0.00 64.86 63.51 1tv4 h ILE 322 Cb 1.12 0.80 -0.01 0.00 -3.07 0.00 0.00 36.82 35.65 1tv4 h ILE 322 CO 0.11 0.29 -0.29 -1.28 -0.69 0.00 0.00 178.15 176.28 1tv4 h SER 323 N 0.67 0.81 -0.37 1.72 0.87 -0.39 -0.96 113.55 115.90 1tv4 h SER 323 Ca 0.15 -0.33 -0.16 0.00 -1.23 0.00 0.00 61.79 60.22 1tv4 h SER 323 Cb 0.32 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.04 1tv4 h SER 323 CO 0.00 1.05 -0.38 -0.08 -0.53 0.00 0.00 176.83 176.90 1tv4 h GLU 324 N 0.67 0.93 -0.01 2.24 4.57 -0.89 -3.36 114.58 118.73 1tv4 h GLU 324 Ca 0.08 -0.49 0.00 0.00 -1.18 0.00 0.00 59.36 57.77 1tv4 h GLU 324 Cb 0.83 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.43 1tv4 h GLU 324 CO 0.07 1.14 -0.18 1.19 -1.18 0.00 0.00 179.01 180.05 1tv4 n PHE 325 N -4.06 0.00 -4.10 0.92 3.01 -0.83 -5.04 117.46 107.36 1tv4 n PHE 325 Ca -0.02 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.32 1tv4 n PHE 325 Cb 0.54 0.00 -0.07 0.00 -0.01 0.00 0.00 39.48 39.94 1tv4 n PHE 325 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 1tv4 s THR 326 N -1.53 0.00 -0.21 4.37 -4.23 -0.37 -5.04 115.64 108.64 1tv4 s THR 326 Ca 0.14 -1.68 0.15 0.00 -1.18 0.00 0.00 61.69 59.12 1tv4 s THR 326 Cb 0.12 -2.40 0.53 0.00 1.34 0.00 0.00 72.50 72.08 1tv4 s THR 326 CO 0.29 0.00 1.44 0.47 -0.54 0.00 0.00 174.62 176.28 1tv4 n ASP 327 N -0.57 3.58 -4.68 3.99 10.43 -1.26 -4.47 116.55 123.57 1tv4 n ASP 327 Ca 0.01 -3.20 -0.42 0.00 2.57 0.00 0.00 54.79 53.75 1tv4 n ASP 327 Cb 0.63 -0.57 -0.03 0.00 1.84 0.00 0.00 41.12 42.99 1tv4 n ASP 327 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1tv4 s ILE 328 N -2.93 3.28 0.27 0.53 1.01 -1.26 -4.84 121.20 117.25 1tv4 s ILE 328 Ca 0.43 0.60 -0.25 0.00 0.00 0.00 0.00 60.65 61.42 1tv4 s ILE 328 Cb 0.36 -3.38 -0.09 0.00 0.01 0.00 0.00 42.46 39.35 1tv4 s ILE 328 CO 0.07 -0.02 0.87 -0.76 0.00 0.00 0.00 174.94 175.10 1tv4 s LEU 329 N 3.14 4.43 0.30 2.97 1.43 -1.26 -4.88 118.68 124.81 1tv4 s LEU 329 Ca 0.73 1.74 -0.14 0.00 -1.03 0.00 0.00 54.13 55.43 1tv4 s LEU 329 Cb -0.37 -3.76 0.02 0.00 0.03 0.00 0.00 46.19 42.11 1tv4 s LEU 329 CO 0.31 0.03 0.61 -0.94 0.23 0.00 0.00 176.35 176.60 1tv4 s SER 330 N -1.49 0.02 0.35 2.29 1.04 -1.26 -1.21 113.70 113.44 1tv4 s SER 330 Ca 0.45 -0.96 -0.01 0.00 0.48 0.00 0.00 55.95 55.90 1tv4 s SER 330 Cb -0.20 0.69 0.00 0.00 0.10 0.00 0.00 66.02 66.61 1tv4 s SER 330 CO 0.25 -1.34 0.46 -0.83 0.98 0.00 0.00 173.24 172.76 1tv4 s GLY 331 N -3.03 1.59 0.02 7.32 0.00 -0.24 -0.59 107.32 112.38 1tv4 s GLY 331 Ca 0.19 -1.58 0.01 0.00 0.00 0.00 0.00 44.72 43.34 1tv4 s GLY 331 CO 0.11 -1.04 -0.05 0.21 0.00 0.00 0.00 173.10 172.32 1tv4 s ASN 332 N -3.26 0.49 0.01 1.64 2.47 -1.03 -0.85 114.94 114.42 1tv4 s ASN 332 Ca 0.31 -0.37 -0.02 0.00 0.42 0.00 0.00 52.86 53.20 1tv4 s ASN 332 Cb -0.00 0.03 -0.04 0.00 -1.45 0.00 0.00 41.25 39.79 1tv4 s ASN 332 CO 0.21 -0.16 0.18 0.00 -3.72 0.00 0.00 177.10 173.62 1tv4 s GLN 333 N -1.06 3.40 -0.26 0.43 -2.07 -0.92 -1.39 119.66 117.79 1tv4 s GLN 333 Ca -0.08 -0.38 -0.09 0.00 -1.82 0.00 0.00 55.36 52.99 1tv4 s GLN 333 Cb -0.07 -3.05 -0.04 0.00 -1.09 0.00 0.00 33.01 28.76 1tv4 s GLN 333 CO -0.00 0.65 0.11 0.71 -1.32 0.00 0.00 175.29 175.44 1tv4 s TYR 334 N -1.37 3.13 -0.52 9.60 1.51 -0.48 -4.80 117.35 124.42 1tv4 s TYR 334 Ca 0.29 -0.24 0.04 0.00 -1.01 0.00 0.00 57.07 56.15 1tv4 s TYR 334 Cb -0.13 -2.29 0.16 0.00 -0.11 0.00 0.00 41.96 39.59 1tv4 s TYR 334 CO 0.21 -0.29 0.36 0.71 -1.11 0.00 0.00 175.55 175.43 1tv4 s TYR 335 N 1.66 2.20 0.62 2.71 1.51 -1.26 -0.39 117.35 124.41 1tv4 s TYR 335 Ca 0.07 -2.70 -0.13 0.00 -1.01 0.00 0.00 57.07 53.30 1tv4 s TYR 335 Cb -0.15 -1.82 -0.03 0.00 -0.11 0.00 0.00 41.96 39.85 1tv4 s TYR 335 CO 0.06 -0.72 1.04 -2.14 -1.11 0.00 0.00 175.55 172.68 1tv4 s PRO 336 N -0.37 3.35 -0.03 -1.71 0.02 -1.25 -2.23 135.00 132.79 1tv4 s PRO 336 Ca 0.25 0.96 -0.22 0.00 0.02 0.00 0.00 61.00 62.01 1tv4 s PRO 336 Cb -0.08 -2.05 -0.27 0.00 0.02 0.00 0.00 34.50 32.13 1tv4 s PRO 336 CO -0.13 -0.77 0.99 0.00 -0.33 0.00 0.00 177.00 176.77 1tv4 s ALA 338 N -2.84 2.54 0.64 0.00 0.00 -1.26 -4.05 121.76 116.79 1tv4 s ALA 338 Ca -0.14 0.48 0.01 0.00 0.00 0.00 0.00 51.96 52.31 1tv4 s ALA 338 Cb 0.02 -3.29 0.09 0.00 0.00 0.00 0.00 23.12 19.94 1tv4 s ALA 338 CO 0.81 -1.17 0.88 0.20 0.00 0.00 0.00 175.76 176.48 1tv4 s GLY 339 N -2.71 1.79 0.91 0.00 0.00 -0.65 -1.05 107.32 105.61 1tv4 s GLY 339 Ca 0.65 -1.63 -0.11 0.00 0.00 0.00 0.00 44.72 43.63 1tv4 s GLY 339 CO 0.41 -1.19 0.91 -1.05 0.00 0.00 0.00 173.10 172.19 1tv4 n PRO 340 N -2.57 -0.30 -3.11 2.90 -0.02 -1.26 -3.63 135.00 127.01 1tv4 n PRO 340 Ca 0.12 -0.03 -0.23 0.00 -2.02 0.00 0.00 63.50 61.35 1tv4 n PRO 340 Cb 0.60 -2.21 0.04 0.00 -0.02 0.00 0.00 33.50 31.92 1tv4 n PRO 340 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1tv4 s THR 342 N -3.20 0.65 0.19 0.00 -4.23 -1.24 -4.80 115.64 103.01 1tv4 s THR 342 Ca 0.35 -1.23 -0.04 0.00 -1.18 0.00 0.00 61.69 59.59 1tv4 s THR 342 Cb -0.15 -0.82 -0.03 0.00 1.34 0.00 0.00 72.50 72.83 1tv4 s THR 342 CO 0.43 -0.43 1.53 -0.08 -0.54 0.00 0.00 174.62 175.53 1tv4 h GLU 343 N 4.26 0.64 -0.43 3.99 4.81 -1.90 -3.19 114.58 122.75 1tv4 h GLU 343 Ca -0.36 -0.36 0.00 0.00 -0.13 0.00 0.00 59.36 58.51 1tv4 h GLU 343 Cb 1.20 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.58 1tv4 h GLU 343 CO 0.44 0.97 0.28 1.98 -0.73 0.00 0.00 179.01 181.94 1tv4 h MET 344 N 0.51 0.58 -0.30 1.92 4.05 -1.97 -0.74 114.93 118.99 1tv4 h MET 344 Ca 0.03 -0.04 0.06 0.00 -0.28 0.00 0.00 59.70 59.47 1tv4 h MET 344 Cb 1.00 -0.13 -0.06 0.00 -0.80 0.00 0.00 31.60 31.62 1tv4 h MET 344 CO 0.09 0.41 -0.08 0.00 0.23 0.00 0.00 176.91 177.56 1tv4 h LEU 346 N -0.00 1.04 -0.74 0.00 3.38 -1.48 -1.46 115.31 116.05 1tv4 h LEU 346 Ca 0.14 -0.14 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 1tv4 h LEU 346 Cb 0.22 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1tv4 h LEU 346 CO -0.31 0.89 -0.38 -0.07 0.09 0.00 0.00 178.44 178.66 1tv4 h LEU 347 N 1.11 0.53 -0.03 1.67 3.38 -0.45 -0.48 115.31 121.05 1tv4 h LEU 347 Ca 0.27 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 1tv4 h LEU 347 Cb 0.14 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 1tv4 h LEU 347 CO -0.03 0.87 0.01 -0.33 0.09 0.00 0.00 178.44 179.04 1tv4 h GLU 348 N 0.42 0.04 -0.34 1.13 5.08 -0.05 -1.16 114.58 119.72 1tv4 h GLU 348 Ca 0.04 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.32 1tv4 h GLU 348 Cb 0.86 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.09 1tv4 h GLU 348 CO 0.07 0.23 -0.09 0.00 -1.00 0.00 0.00 179.01 178.22 1tv4 h ALA 349 N 0.81 1.21 -0.62 3.43 0.00 -1.22 -2.73 119.26 120.14 1tv4 h ALA 349 Ca 0.01 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 1tv4 h ALA 349 Cb 0.21 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1tv4 h ALA 349 CO -0.00 0.51 0.26 0.77 0.00 0.00 0.00 179.25 180.79 1tv4 h SER 350 N 0.52 0.85 -0.82 0.00 0.02 -0.86 -0.01 113.55 113.25 1tv4 h SER 350 Ca 0.10 -0.16 0.01 0.00 -0.84 0.00 0.00 61.79 60.89 1tv4 h SER 350 Cb 0.48 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.76 1tv4 h SER 350 CO 0.03 0.78 0.54 0.00 -1.14 0.00 0.00 176.83 177.03 1tv4 h ALA 351 N 1.11 1.04 -0.19 3.77 0.00 -0.92 -0.79 119.26 123.29 1tv4 h ALA 351 Ca 0.21 -0.06 -0.17 0.00 0.00 0.00 0.00 54.91 54.89 1tv4 h ALA 351 Cb 0.18 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 1tv4 h ALA 351 CO -0.02 0.46 -0.58 0.37 0.00 0.00 0.00 179.25 179.48 1tv4 h GLN 352 N 1.12 0.60 -0.77 0.00 4.15 -1.23 -2.10 115.11 116.87 1tv4 h GLN 352 Ca 0.30 -0.39 -0.03 0.00 0.77 0.00 0.00 58.65 59.30 1tv4 h GLN 352 Cb -0.12 0.05 -0.04 0.00 0.21 0.00 0.00 27.48 27.59 1tv4 h GLN 352 CO -0.06 1.01 0.38 1.03 -1.93 0.00 0.00 178.83 179.25 1tv4 h SER 353 N 0.45 1.00 -0.10 -0.69 0.87 -0.54 0.32 113.55 114.87 1tv4 h SER 353 Ca 0.00 -0.13 -0.00 0.00 -1.23 0.00 0.00 61.79 60.43 1tv4 h SER 353 Cb 1.14 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 62.84 1tv4 h SER 353 CO 0.11 0.85 0.05 0.40 -0.53 0.00 0.00 176.83 177.71 1tv4 h ILE 354 N 1.08 1.12 0.13 2.23 2.04 -1.06 0.14 117.51 123.19 1tv4 h ILE 354 Ca 0.27 -0.35 -0.00 0.00 1.00 0.00 0.00 64.86 65.78 1tv4 h ILE 354 Cb 0.11 1.17 -0.00 0.00 -0.74 0.00 0.00 36.82 37.36 1tv4 h ILE 354 CO -0.03 0.10 -0.09 0.74 0.00 0.00 0.00 178.15 178.87 1tv4 h THR 355 N 0.03 0.81 -0.55 -0.27 2.02 -0.97 -1.23 112.91 112.75 1tv4 h THR 355 Ca 0.03 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.18 1tv4 h THR 355 Cb 0.13 0.81 -0.02 0.00 -1.74 0.00 0.00 68.15 67.32 1tv4 h THR 355 CO -0.00 0.00 0.22 0.44 0.37 0.00 0.00 175.52 176.55 1tv4 h ASP 356 N -0.22 0.75 0.19 4.18 3.32 -0.33 -0.34 116.42 123.97 1tv4 h ASP 356 Ca -0.01 -0.17 -0.01 0.00 0.02 0.00 0.00 57.03 56.87 1tv4 h ASP 356 Cb 0.19 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.54 1tv4 h ASP 356 CO 0.00 0.71 -0.09 0.74 -1.72 0.00 0.00 179.24 178.89 1tv4 h THR 357 N 0.75 0.91 -0.21 0.35 2.02 -0.89 -0.58 112.91 115.25 1tv4 h THR 357 Ca 0.18 -0.48 -0.07 0.00 0.77 0.00 0.00 66.41 66.81 1tv4 h THR 357 Cb 0.19 1.20 -0.01 0.00 -1.74 0.00 0.00 68.15 67.79 1tv4 h THR 357 CO -0.02 0.11 -0.16 0.00 0.37 0.00 0.00 175.52 175.83 1tv4 h ALA 358 N 0.27 1.34 0.00 6.16 0.00 -1.21 -2.67 119.26 123.17 1tv4 h ALA 358 Ca -0.03 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1tv4 h ALA 358 Cb 0.37 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1tv4 h ALA 358 CO 0.04 0.44 0.00 -1.13 0.00 0.00 0.00 179.25 178.61 1tv4 n SER 359 N -4.21 0.00 0.00 0.00 3.41 -0.14 -0.34 113.62 112.33 1tv4 n SER 359 Ca -0.00 -0.35 0.00 0.00 -0.26 0.00 0.00 58.87 58.26 1tv4 n SER 359 Cb 0.32 -0.21 0.00 0.00 -0.26 0.00 0.00 64.21 64.05 1tv4 n SER 359 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1tv4 n GLY 360 N 1.19 1.05 3.76 5.00 0.00 -1.00 -2.99 105.19 112.19 1tv4 n GLY 360 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 1tv4 n GLY 360 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1tv4 s ARG 361 N -0.23 3.27 -0.04 1.61 1.81 -0.24 -4.43 118.95 120.70 1tv4 s ARG 361 Ca 0.00 1.78 0.14 0.00 -1.72 0.00 0.00 55.73 55.93 1tv4 s ARG 361 Cb 0.00 -2.08 -0.22 0.00 -0.45 0.00 0.00 34.95 32.21 1tv4 s ARG 361 CO 0.00 -0.95 0.63 0.39 -0.68 0.00 0.00 175.30 174.68 1tv4 n GLU 362 N -1.22 0.64 -4.07 3.54 4.71 0.24 -4.68 120.64 119.79 1tv4 n GLU 362 Ca 0.11 0.24 -0.15 0.00 -0.01 0.00 0.00 57.16 57.35 1tv4 n GLU 362 Cb 0.49 -1.76 -0.15 0.00 -1.01 0.00 0.00 31.44 29.01 1tv4 n GLU 362 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 1tv4 s ILE 363 N -2.66 0.30 -0.23 -3.67 1.01 -0.93 -0.50 121.20 114.51 1tv4 s ILE 363 Ca -0.05 -0.13 -0.05 0.00 0.00 0.00 0.00 60.65 60.42 1tv4 s ILE 363 Cb 0.08 -0.28 -0.01 0.00 0.01 0.00 0.00 42.46 42.26 1tv4 s ILE 363 CO 0.82 0.10 -0.01 -0.76 0.00 0.00 0.00 174.94 175.09 1tv4 s LEU 364 N 0.10 3.08 -0.38 2.97 1.43 -0.03 -2.47 118.68 123.38 1tv4 s LEU 364 Ca -0.01 -0.41 -0.03 0.00 -1.03 0.00 0.00 54.13 52.66 1tv4 s LEU 364 Cb -0.04 -1.78 0.09 0.00 0.03 0.00 0.00 46.19 44.49 1tv4 s LEU 364 CO -0.00 -0.04 0.15 -0.55 0.23 0.00 0.00 176.35 176.13 1tv4 s SER 365 N 1.50 5.17 0.36 2.29 0.15 -0.48 0.00 113.70 122.69 1tv4 s SER 365 Ca 0.05 -1.78 -0.11 0.00 0.70 0.00 0.00 55.95 54.81 1tv4 s SER 365 Cb -0.15 -1.80 0.04 0.00 -1.71 0.00 0.00 66.02 62.40 1tv4 s SER 365 CO -0.02 -0.46 0.68 0.61 1.20 0.00 0.00 173.24 175.25 1tv4 n GLY 366 N 4.61 1.31 3.13 9.45 0.00 -0.58 -1.38 105.19 121.73 1tv4 n GLY 366 Ca -0.06 -1.33 -0.29 0.00 0.00 0.00 0.00 46.02 44.34 1tv4 n GLY 366 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1tv4 s VAL 367 N -2.31 1.68 -1.34 1.61 1.01 -1.00 -1.06 120.40 118.98 1tv4 s VAL 367 Ca 0.18 -0.79 -0.11 0.00 0.00 0.00 0.00 61.98 61.26 1tv4 s VAL 367 Cb -0.04 -1.48 0.12 0.00 0.00 0.00 0.00 36.38 34.98 1tv4 s VAL 367 CO 0.13 0.48 1.99 0.00 0.00 0.00 0.00 175.10 177.69 1tv4 n ALA 368 N 3.75 5.35 -1.14 5.51 0.00 0.48 -4.60 120.51 129.86 1tv4 n ALA 368 Ca -0.20 -4.15 -0.34 0.00 0.00 0.00 0.00 53.44 48.75 1tv4 n ALA 368 Cb 0.52 -3.20 0.11 0.00 0.00 0.00 0.00 19.45 16.89 1tv4 n ALA 368 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1tv4 n SER 369 N 4.82 0.25 -3.13 0.00 7.64 -1.26 -1.50 113.62 120.44 1tv4 n SER 369 Ca 0.44 0.57 -0.23 0.00 1.01 0.00 0.00 58.87 60.67 1tv4 n SER 369 Cb 0.38 -1.41 0.03 0.00 -1.01 0.00 0.00 64.21 62.19 1tv4 n SER 369 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1tv4 n ALA 370 N -3.06 -1.02 -1.32 -0.43 0.00 -0.21 -0.89 120.51 113.58 1tv4 n ALA 370 Ca 0.12 0.26 -0.11 0.00 0.00 0.00 0.00 53.44 53.71 1tv4 n ALA 370 Cb 0.50 -3.80 -0.05 0.00 0.00 0.00 0.00 19.45 16.11 1tv4 n ALA 370 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1tv4 n LYS 371 N -4.05 -1.53 -1.75 0.00 5.02 0.04 -3.05 118.16 112.84 1tv4 n LYS 371 Ca -0.09 0.87 -0.19 0.00 -2.02 0.00 0.00 58.31 56.89 1tv4 n LYS 371 Cb 0.60 -5.20 -0.06 0.00 -0.02 0.00 0.00 35.03 30.34 1tv4 n LYS 371 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1tv4 n GLY 372 N -0.11 1.27 0.00 0.72 0.00 -0.07 -4.86 105.19 102.15 1tv4 n GLY 372 Ca -0.11 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.81 1tv4 n GLY 372 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1tv4 n VAL 373 N -2.85 0.94 -4.10 1.61 0.24 -1.17 -4.29 118.33 108.72 1tv4 n VAL 373 Ca -0.20 -0.96 -0.34 0.00 -2.04 0.00 0.00 64.34 60.81 1tv4 n VAL 373 Cb 0.63 0.52 -0.15 0.00 -1.47 0.00 0.00 33.84 33.37 1tv4 n VAL 373 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1tv4 s VAL 374 N -0.98 2.80 -0.04 3.34 1.01 -1.26 -4.93 120.40 120.34 1tv4 s VAL 374 Ca 0.01 -0.70 -0.38 0.00 0.00 0.00 0.00 61.98 60.92 1tv4 s VAL 374 Cb 0.01 -2.23 -0.16 0.00 0.00 0.00 0.00 36.38 34.00 1tv4 s VAL 374 CO 0.00 0.48 1.50 0.41 0.00 0.00 0.00 175.10 177.49 1tv4 n THR 375 N 4.59 0.12 -1.16 3.92 -1.04 -1.26 -2.00 114.28 117.45 1tv4 n THR 375 Ca -0.19 -0.02 -0.05 0.00 -2.04 0.00 0.00 64.05 61.74 1tv4 n THR 375 Cb 0.51 -1.00 -0.02 0.00 -1.82 0.00 0.00 70.33 68.00 1tv4 n THR 375 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1tv4 n ASP 376 N 3.61 -5.41 -3.54 8.00 8.00 0.20 -4.90 116.55 122.51 1tv4 n ASP 376 Ca 0.21 0.13 -0.40 0.00 0.71 0.00 0.00 54.79 55.44 1tv4 n ASP 376 Cb 0.17 -3.38 0.01 0.00 -0.02 0.00 0.00 41.12 37.90 1tv4 n ASP 376 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1tv4 n LYS 377 N -0.50 5.03 -3.68 -1.24 5.02 -0.85 -0.66 118.16 121.28 1tv4 n LYS 377 Ca -0.05 -4.18 -0.10 0.00 -2.02 0.00 0.00 58.31 51.95 1tv4 n LYS 377 Cb 0.47 -2.51 -0.09 0.00 -0.02 0.00 0.00 35.03 32.88 1tv4 n LYS 377 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1tv4 s THR 378 N -3.26 -0.01 0.10 -0.18 -4.23 -1.26 -4.20 115.64 102.61 1tv4 s THR 378 Ca 0.45 0.04 -0.05 0.00 -1.18 0.00 0.00 61.69 60.95 1tv4 s THR 378 Cb 0.20 -0.75 -0.02 0.00 1.34 0.00 0.00 72.50 73.27 1tv4 s THR 378 CO -0.13 0.02 0.13 0.42 -0.54 0.00 0.00 174.62 174.51 1tv4 s THR 379 N 1.12 0.14 0.62 3.99 -4.23 -1.26 -4.65 115.64 111.38 1tv4 s THR 379 Ca -0.07 -1.52 0.34 0.00 -1.18 0.00 0.00 61.69 59.26 1tv4 s THR 379 Cb -0.06 -1.62 0.38 0.00 1.34 0.00 0.00 72.50 72.54 1tv4 s THR 379 CO -0.11 -0.64 2.20 1.23 -0.54 0.00 0.00 174.62 176.77 1tv4 h GLY 380 N 2.84 0.00 0.97 3.99 0.00 -1.84 -2.54 103.07 106.49 1tv4 h GLY 380 Ca -0.34 0.00 0.05 0.00 0.00 0.00 0.00 47.33 47.04 1tv4 h GLY 380 CO 0.58 0.00 0.55 -0.33 0.00 0.00 0.00 176.54 177.34 1tv4 h MET 381 N 0.00 0.96 -0.45 4.80 2.07 -1.97 -0.42 114.93 119.91 1tv4 h MET 381 Ca 0.03 -0.06 -0.09 0.00 -2.07 0.00 0.00 59.70 57.51 1tv4 h MET 381 Cb 0.24 -0.22 -0.02 0.00 -1.87 0.00 0.00 31.60 29.74 1tv4 h MET 381 CO -0.00 0.63 -0.08 0.93 1.07 0.00 0.00 176.91 179.47 1tv4 h GLU 382 N 0.99 0.80 -0.15 1.72 3.07 -1.87 -2.35 114.58 116.79 1tv4 h GLU 382 Ca 0.35 -0.25 -0.12 0.00 -0.50 0.00 0.00 59.36 58.84 1tv4 h GLU 382 Cb 0.14 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 27.96 1tv4 h GLU 382 CO -0.12 0.85 -0.44 0.00 -1.40 0.00 0.00 179.01 177.90 1tv4 h ALA 383 N 1.19 0.96 -0.49 3.43 0.00 -1.44 -1.60 119.26 121.31 1tv4 h ALA 383 Ca 0.13 -0.45 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 1tv4 h ALA 383 Cb 0.55 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1tv4 h ALA 383 CO 0.03 0.63 0.29 -0.09 0.00 0.00 0.00 179.25 180.12 1tv4 h ARG 384 N 0.29 0.66 -0.41 0.00 2.43 -0.66 -0.21 114.38 116.48 1tv4 h ARG 384 Ca 0.02 -0.06 -0.05 0.00 -0.81 0.00 0.00 59.98 59.07 1tv4 h ARG 384 Cb 0.90 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.30 1tv4 h ARG 384 CO 0.07 0.49 0.04 1.98 -1.51 0.00 0.00 179.97 181.05 1tv4 h MET 385 N 0.65 0.69 -0.52 0.20 4.05 -1.24 0.22 114.93 118.98 1tv4 h MET 385 Ca 0.17 -0.20 0.08 0.00 -0.28 0.00 0.00 59.70 59.48 1tv4 h MET 385 Cb 0.00 -0.07 -0.07 0.00 -0.80 0.00 0.00 31.60 30.66 1tv4 h MET 385 CO -0.03 0.75 0.14 1.98 0.23 0.00 0.00 176.91 179.97 1tv4 h MET 386 N 0.54 0.28 -0.19 0.39 1.85 -0.92 0.20 114.93 117.08 1tv4 h MET 386 Ca 0.12 -0.02 -0.07 0.00 -0.61 0.00 0.00 59.70 59.12 1tv4 h MET 386 Cb 0.41 -0.06 -0.00 0.00 0.43 0.00 0.00 31.60 32.37 1tv4 h MET 386 CO 0.01 0.18 -0.16 0.78 -0.40 0.00 0.00 176.91 177.32 1tv4 h GLY 387 N 0.28 0.48 1.62 1.39 0.00 -0.77 -2.00 103.07 104.08 1tv4 h GLY 387 Ca 0.26 -0.48 -0.05 0.00 0.00 0.00 0.00 47.33 47.06 1tv4 h GLY 387 CO -0.31 0.43 -0.04 0.83 0.00 0.00 0.00 176.54 177.45 1tv4 h GLU 388 N 0.10 0.47 -0.06 4.80 5.08 -0.67 -1.81 114.58 122.50 1tv4 h GLU 388 Ca 0.03 -0.11 -0.15 0.00 -1.00 0.00 0.00 59.36 58.14 1tv4 h GLU 388 Cb 0.69 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 1tv4 h GLU 388 CO 0.04 0.53 -0.62 0.28 -1.00 0.00 0.00 179.01 178.24 1tv4 h VAL 389 N 0.45 1.39 -0.45 3.13 2.07 -0.95 -2.14 116.25 119.76 1tv4 h VAL 389 Ca 0.10 -2.02 -0.03 0.00 0.82 0.00 0.00 66.70 65.56 1tv4 h VAL 389 Cb 0.35 2.03 -0.02 0.00 -1.52 0.00 0.00 31.29 32.13 1tv4 h VAL 389 CO 0.01 0.60 0.15 0.00 0.02 0.00 0.00 177.57 178.35 1tv4 h ALA 390 N 1.18 0.58 -0.46 1.67 0.00 -0.57 -0.90 119.26 120.77 1tv4 h ALA 390 Ca -0.01 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 1tv4 h ALA 390 Cb 1.13 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 1tv4 h ALA 390 CO 0.10 0.22 0.20 -0.09 0.00 0.00 0.00 179.25 179.67 1tv4 h ARG 391 N 0.58 0.67 -0.44 0.00 9.65 -1.26 -1.43 114.38 122.16 1tv4 h ARG 391 Ca 0.14 -0.11 -0.01 0.00 -1.10 0.00 0.00 59.98 58.90 1tv4 h ARG 391 Cb 0.25 -0.11 -0.02 0.00 -1.39 0.00 0.00 29.97 28.69 1tv4 h ARG 391 CO -0.01 0.60 0.25 0.00 2.80 0.00 0.00 179.97 183.61 1tv4 h ALA 392 N 1.04 1.61 0.05 2.80 0.00 -1.10 -2.88 119.26 120.78 1tv4 h ALA 392 Ca 0.15 -0.07 -0.23 0.00 0.00 0.00 0.00 54.91 54.77 1tv4 h ALA 392 Cb 0.17 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1tv4 h ALA 392 CO -0.02 0.34 -1.04 1.15 0.00 0.00 0.00 179.25 179.68 1tv4 h THR 393 N 0.61 1.54 -1.93 0.00 2.02 -0.83 -3.42 112.91 110.90 1tv4 h THR 393 Ca 0.16 -2.95 -0.64 0.00 0.77 0.00 0.00 66.41 63.75 1tv4 h THR 393 Cb 0.01 2.72 0.05 0.00 -1.74 0.00 0.00 68.15 69.19 1tv4 h THR 393 CO -0.03 0.86 0.67 0.00 0.37 0.00 0.00 175.52 177.39 1tv4 n ALA 394 N -2.47 0.14 0.00 6.16 0.00 -0.57 -1.61 120.51 122.16 1tv4 n ALA 394 Ca -0.05 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.86 1tv4 n ALA 394 Cb 0.91 -2.23 0.00 0.00 0.00 0.00 0.00 19.45 18.14 1tv4 n ALA 394 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tv4 n GLY 395 N 3.14 2.51 3.76 0.00 0.00 -0.72 -4.86 105.19 109.01 1tv4 n GLY 395 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 1tv4 n GLY 395 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1tv4 s VAL 396 N -2.66 3.34 0.31 1.61 1.01 -0.63 -4.94 120.40 118.43 1tv4 s VAL 396 Ca 0.00 1.33 -0.29 0.00 0.00 0.00 0.00 61.98 63.02 1tv4 s VAL 396 Cb 0.00 -3.85 -0.12 0.00 0.00 0.00 0.00 36.38 32.41 1tv4 s VAL 396 CO 0.00 0.31 1.43 -0.62 0.00 0.00 0.00 175.10 176.22 1tv4 n GLU 397 N 1.21 2.33 -0.19 2.72 1.02 -1.26 -4.83 120.64 121.64 1tv4 n GLU 397 Ca -0.01 0.82 0.03 0.00 -0.02 0.00 0.00 57.16 57.99 1tv4 n GLU 397 Cb 0.44 -2.50 0.29 0.00 -0.02 0.00 0.00 31.44 29.66 1tv4 n GLU 397 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1tv4 h ILE 398 N 2.94 1.13 -0.64 -3.67 1.08 -1.96 -1.22 117.51 115.17 1tv4 h ILE 398 Ca -0.47 -0.31 0.04 0.00 -0.39 0.00 0.00 64.86 63.73 1tv4 h ILE 398 Cb 1.26 0.15 -0.05 0.00 -3.07 0.00 0.00 36.82 35.12 1tv4 h ILE 398 CO 0.70 0.16 0.38 0.77 -0.69 0.00 0.00 178.15 179.48 1tv4 h SER 399 N 0.90 0.61 -0.35 1.72 4.64 -1.95 -0.55 113.55 118.57 1tv4 h SER 399 Ca 0.28 0.01 -0.13 0.00 -0.47 0.00 0.00 61.79 61.48 1tv4 h SER 399 Cb 0.00 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 61.97 1tv4 h SER 399 CO -0.07 0.41 -0.26 -0.33 -0.87 0.00 0.00 176.83 175.71 1tv4 h GLU 400 N 0.74 0.86 -0.46 4.77 5.08 -1.73 -2.99 114.58 120.86 1tv4 h GLU 400 Ca 0.27 -0.38 -0.00 0.00 -1.00 0.00 0.00 59.36 58.25 1tv4 h GLU 400 Cb 0.08 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 1tv4 h GLU 400 CO -0.13 1.02 0.28 0.28 -1.00 0.00 0.00 179.01 179.46 1tv4 h VAL 401 N 0.74 1.14 -0.86 3.13 2.07 -0.60 -1.38 116.25 120.50 1tv4 h VAL 401 Ca 0.09 -0.31 0.03 0.00 0.82 0.00 0.00 66.70 67.33 1tv4 h VAL 401 Cb 0.81 0.53 -0.05 0.00 -1.52 0.00 0.00 31.29 31.05 1tv4 h VAL 401 CO 0.07 0.14 0.56 0.78 0.02 0.00 0.00 177.57 179.14 1tv4 h ASN 402 N 0.61 0.92 -0.19 0.57 2.35 -1.05 0.37 115.58 119.15 1tv4 h ASN 402 Ca 0.16 -0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.86 1tv4 h ASN 402 Cb -0.01 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.14 1tv4 h ASN 402 CO -0.03 0.64 -0.04 0.58 -1.65 0.00 0.00 177.43 176.92 1tv4 h VAL 403 N 1.07 1.28 -0.56 2.81 2.07 -1.31 -2.07 116.25 119.54 1tv4 h VAL 403 Ca 0.34 -1.01 0.01 0.00 0.82 0.00 0.00 66.70 66.86 1tv4 h VAL 403 Cb 0.02 1.56 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 1tv4 h VAL 403 CO -0.10 0.30 0.35 0.40 0.02 0.00 0.00 177.57 178.55 1tv4 h ILE 404 N 0.08 1.11 -0.42 4.57 2.04 -0.73 -2.26 117.51 121.90 1tv4 h ILE 404 Ca 0.05 -0.25 -0.00 0.00 1.00 0.00 0.00 64.86 65.66 1tv4 h ILE 404 Cb 0.48 0.33 -0.02 0.00 -0.74 0.00 0.00 36.82 36.87 1tv4 h ILE 404 CO 0.02 0.13 0.25 -0.07 0.00 0.00 0.00 178.15 178.48 1tv4 h LEU 405 N 0.71 0.50 -0.62 1.44 3.38 -0.88 0.11 115.31 119.96 1tv4 h LEU 405 Ca 0.21 -0.06 0.04 0.00 0.09 0.00 0.00 57.88 58.16 1tv4 h LEU 405 Cb -0.04 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.54 1tv4 h LEU 405 CO -0.07 0.41 0.36 -0.78 0.09 0.00 0.00 178.44 178.46 1tv4 h ASP 406 N 0.55 0.56 -0.24 -0.43 3.58 -1.11 -0.29 116.42 119.03 1tv4 h ASP 406 Ca 0.15 0.02 -0.06 0.00 0.42 0.00 0.00 57.03 57.55 1tv4 h ASP 406 Cb 0.01 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 40.95 1tv4 h ASP 406 CO -0.03 0.38 -0.09 0.11 -2.88 0.00 0.00 179.24 176.73 1tv4 h LYS 407 N 0.69 0.49 0.03 0.28 1.57 -1.07 -2.81 116.57 115.76 1tv4 h LYS 407 Ca 0.26 -0.20 -0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1tv4 h LYS 407 Cb 0.10 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.39 1tv4 h LYS 407 CO -0.14 0.74 -0.02 1.25 -0.57 0.00 0.00 179.45 180.72 1tv4 h LEU 408 N 0.22 -0.04 -1.59 2.94 5.85 -0.53 -2.76 115.31 119.41 1tv4 h LEU 408 Ca 0.06 -0.16 0.06 0.00 0.84 0.00 0.00 57.88 58.68 1tv4 h LEU 408 Cb 0.58 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 1tv4 h LEU 408 CO 0.03 0.14 0.36 0.58 -0.34 0.00 0.00 178.44 179.21 1tv4 h VAL 409 N -0.21 0.99 0.00 1.05 2.07 -1.14 0.10 116.25 119.12 1tv4 h VAL 409 Ca -0.00 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 1tv4 h VAL 409 Cb 0.19 0.44 -0.00 0.00 -1.52 0.00 0.00 31.29 30.40 1tv4 h VAL 409 CO 0.01 0.09 -0.06 0.28 0.02 0.00 0.00 177.57 177.91 1tv4 h SER 410 N 0.51 0.00 0.80 0.57 0.02 -1.21 -0.34 113.55 113.90 1tv4 h SER 410 Ca 0.24 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.19 1tv4 h SER 410 Cb 0.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.82 1tv4 h SER 410 CO -0.07 0.06 0.00 0.18 -1.14 0.00 0.00 176.83 175.86 1tv4 n LEU 411 N -3.37 0.33 0.00 5.07 4.77 0.35 -4.21 117.00 119.94 1tv4 n LEU 411 Ca -0.02 0.56 0.00 0.00 -0.03 0.00 0.00 56.01 56.53 1tv4 n LEU 411 Cb 0.20 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.79 1tv4 n LEU 411 CO 0.27 -0.30 0.00 0.00 -1.33 0.00 0.00 177.39 176.03 1tv4 n TYR 412 N -1.85 0.00 0.06 -1.77 0.18 -0.87 -4.89 117.16 108.02 1tv4 n TYR 412 Ca 0.04 0.00 0.02 0.00 1.88 0.00 0.00 57.90 59.84 1tv4 n TYR 412 Cb 0.26 0.00 0.08 0.00 -0.38 0.00 0.00 39.34 39.30 1tv4 n TYR 412 CO 0.00 0.00 0.00 -0.85 -2.08 0.00 0.00 176.86 173.93 1tv4 n GLU 413 N 0.00 0.01 0.00 -3.48 0.28 -0.19 -0.71 120.64 116.55 1tv4 n GLU 413 Ca 0.00 0.49 0.12 0.00 -0.16 0.00 0.00 57.16 57.61 1tv4 n GLU 413 Cb 0.00 -1.54 0.22 0.00 1.43 0.00 0.00 31.44 31.54 1tv4 n GLU 413 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1tv4 n LYS 414 N -1.57 1.59 -0.24 3.44 5.02 -1.26 -4.31 118.16 120.82 1tv4 n LYS 414 Ca 0.00 -1.19 0.08 0.00 -2.02 0.00 0.00 58.31 55.19 1tv4 n LYS 414 Cb 0.02 -1.48 0.18 0.00 -0.02 0.00 0.00 35.03 33.74 1tv4 n LYS 414 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1tv4 n ASN 415 N 0.33 3.04 -0.11 4.39 5.03 0.11 -4.76 115.26 123.29 1tv4 n ASN 415 Ca 0.13 -2.88 -0.05 0.00 0.87 0.00 0.00 54.58 52.65 1tv4 n ASN 415 Cb 0.46 -0.43 0.03 0.00 -1.02 0.00 0.00 39.78 38.82 1tv4 n ASN 415 CO 0.00 0.00 0.00 1.88 -1.83 0.00 0.00 177.26 177.31 1tv4 h TYR 416 N 0.96 0.10 0.00 3.10 0.99 -1.75 0.71 116.97 121.08 1tv4 h TYR 416 Ca 0.00 0.02 -0.05 0.00 2.00 0.00 0.00 58.73 60.71 1tv4 h TYR 416 Cb 1.13 0.01 -0.01 0.00 1.00 0.00 0.00 36.73 38.87 1tv4 h TYR 416 CO 0.24 -0.00 -0.23 0.00 -0.00 0.00 0.00 178.16 178.17 1tv4 h ALA 417 N 1.30 1.37 -0.39 3.88 0.00 -1.94 -2.86 119.26 120.61 1tv4 h ALA 417 Ca 0.19 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 1tv4 h ALA 417 Cb 0.23 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.93 1tv4 h ALA 417 CO -0.25 0.28 0.04 -1.13 0.00 0.00 0.00 179.25 178.19 1tv4 n SER 418 N -3.89 3.82 -4.69 0.00 3.41 -0.65 -5.02 113.62 106.59 1tv4 n SER 418 Ca -0.02 -3.23 -0.44 0.00 -0.26 0.00 0.00 58.87 54.92 1tv4 n SER 418 Cb 0.31 -0.61 -0.03 0.00 -0.26 0.00 0.00 64.21 63.62 1tv4 n SER 418 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1tv4 n ALA 419 N -0.55 1.77 -1.80 7.33 0.00 0.15 -4.90 120.51 122.52 1tv4 n ALA 419 Ca 0.29 0.42 -0.41 0.00 0.00 0.00 0.00 53.44 53.73 1tv4 n ALA 419 Cb 1.04 -2.38 -0.02 0.00 0.00 0.00 0.00 19.45 18.10 1tv4 n ALA 419 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1tv4 s PRO 420 N 0.36 4.18 0.48 0.00 0.04 -1.26 -4.85 135.00 133.94 1tv4 s PRO 420 Ca 0.73 2.47 0.17 0.00 0.04 0.00 0.00 61.00 64.41 1tv4 s PRO 420 Cb -0.61 -3.04 1.16 0.00 0.04 0.00 0.00 34.50 32.05 1tv4 s PRO 420 CO 0.42 -0.52 2.05 0.00 0.04 0.00 0.00 177.00 178.98 1tv4 h ALA 421 N 4.49 1.69 -0.65 8.56 0.00 -1.92 -1.72 119.26 129.71 1tv4 h ALA 421 Ca -0.47 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1tv4 h ALA 421 Cb 1.22 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1tv4 h ALA 421 CO 0.75 0.16 0.00 0.41 0.00 0.00 0.00 179.25 180.58 1tv4 n GLY 422 N -1.09 -1.40 3.41 0.00 0.00 -1.26 -3.57 105.19 101.28 1tv4 n GLY 422 Ca -0.03 -1.23 -0.20 0.00 0.00 0.00 0.00 46.02 44.56 1tv4 n GLY 422 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tv4 s LYS 423 N 0.00 1.55 0.71 1.61 1.02 -0.40 -4.87 119.74 119.37 1tv4 s LYS 423 Ca 0.00 -1.84 -0.07 0.00 0.02 0.00 0.00 55.97 54.09 1tv4 s LYS 423 Cb 0.00 -0.80 0.06 0.00 -0.52 0.00 0.00 37.83 36.57 1tv4 s LYS 423 CO 0.00 -0.15 1.02 0.95 -0.92 0.00 0.00 175.35 176.25 1tv4 s THR 424 N -3.32 2.29 0.20 2.17 -4.23 -1.26 -4.04 115.64 107.44 1tv4 s THR 424 Ca 0.34 -0.25 -0.10 0.00 -1.18 0.00 0.00 61.69 60.49 1tv4 s THR 424 Cb 0.07 -3.01 0.12 0.00 1.34 0.00 0.00 72.50 71.03 1tv4 s THR 424 CO 0.13 -0.01 1.78 0.15 -0.54 0.00 0.00 174.62 176.14 1tv4 h PHE 425 N -0.61 0.53 0.00 3.99 3.57 -1.15 -1.23 116.94 122.04 1tv4 h PHE 425 Ca -0.44 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.07 1tv4 h PHE 425 Cb 1.32 -0.15 -0.00 0.00 2.79 0.00 0.00 35.95 39.91 1tv4 h PHE 425 CO 0.34 0.22 -0.04 1.96 -2.23 0.00 0.00 178.31 178.56 1tv4 h GLN 426 N 0.54 0.00 0.00 1.11 7.50 -1.84 -1.66 115.11 120.76 1tv4 h GLN 426 Ca 0.28 0.00 -0.06 0.00 0.50 0.00 0.00 58.65 59.37 1tv4 h GLN 426 Cb 0.24 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.76 1tv4 h GLN 426 CO -0.21 0.04 -0.80 0.93 -1.50 0.00 0.00 178.83 177.29 1tv4 h GLU 427 N 0.00 0.00 0.00 1.46 5.08 -1.61 -3.38 114.58 116.14 1tv4 h GLU 427 Ca -0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1tv4 h GLU 427 Cb 0.08 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 1tv4 h GLU 427 CO 0.01 0.15 -0.22 0.00 -1.00 0.00 0.00 179.01 177.94 1tv4 s TYR 429 N -2.16 0.15 -0.52 0.00 1.51 -0.64 -1.44 117.35 114.26 1tv4 s TYR 429 Ca 0.26 -0.40 -0.24 0.00 -1.01 0.00 0.00 57.07 55.67 1tv4 s TYR 429 Cb 0.23 -0.11 0.04 0.00 -0.11 0.00 0.00 41.96 42.01 1tv4 s TYR 429 CO 0.00 -0.35 0.92 0.34 -1.11 0.00 0.00 175.55 175.35 1tv4 s ASP 430 N -1.94 6.38 0.51 2.29 -1.08 0.16 -4.71 116.67 118.27 1tv4 s ASP 430 Ca -0.07 -0.24 0.21 0.00 -0.52 0.00 0.00 52.55 51.92 1tv4 s ASP 430 Cb -0.03 -2.43 1.31 0.00 -1.46 0.00 0.00 42.92 40.31 1tv4 s ASP 430 CO -0.03 -1.15 2.03 0.58 0.52 0.00 0.00 175.17 177.12 1tv4 h VAL 431 N 6.03 0.83 -0.00 1.11 2.07 -1.86 0.22 116.25 124.65 1tv4 h VAL 431 Ca -0.26 -0.02 -0.04 0.00 0.82 0.00 0.00 66.70 67.20 1tv4 h VAL 431 Cb 1.08 0.76 0.00 0.00 -1.52 0.00 0.00 31.29 31.61 1tv4 h VAL 431 CO 1.06 0.01 -0.17 0.11 0.02 0.00 0.00 177.57 178.60 1tv4 h LYS 432 N 0.06 0.12 -0.01 1.57 1.57 -1.97 -3.31 116.57 114.60 1tv4 h LYS 432 Ca 0.19 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1tv4 h LYS 432 Cb 0.67 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.02 1tv4 h LYS 432 CO -0.01 0.88 -0.17 0.25 -0.57 0.00 0.00 179.45 179.82 1tv4 n THR 433 N -4.57 0.00 -3.68 -0.16 -2.24 -1.17 -4.96 114.28 97.50 1tv4 n THR 433 Ca -0.10 -0.20 -0.23 0.00 -2.27 0.00 0.00 64.05 61.25 1tv4 n THR 433 Cb 0.47 0.55 0.03 0.00 -2.10 0.00 0.00 70.33 69.28 1tv4 n THR 433 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1tv4 n VAL 434 N -0.22 -5.09 -4.87 2.28 0.31 0.76 -5.00 118.33 106.50 1tv4 n VAL 434 Ca 0.14 -0.68 -0.26 0.00 -0.01 0.00 0.00 64.34 63.53 1tv4 n VAL 434 Cb 0.37 -4.06 -0.16 0.00 -0.91 0.00 0.00 33.84 29.08 1tv4 n VAL 434 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1tv4 s THR 435 N -3.63 1.47 0.67 2.52 2.01 -1.10 -4.84 115.64 112.73 1tv4 s THR 435 Ca 0.15 -0.75 -0.16 0.00 0.31 0.00 0.00 61.69 61.24 1tv4 s THR 435 Cb -0.04 -1.26 0.00 0.00 0.01 0.00 0.00 72.50 71.21 1tv4 s THR 435 CO 0.82 0.42 1.18 -2.16 -0.69 0.00 0.00 174.62 174.20 1tv4 s PRO 436 N -0.03 2.58 0.63 4.92 0.04 -1.26 0.38 135.00 142.26 1tv4 s PRO 436 Ca -0.03 1.68 -0.10 0.00 0.04 0.00 0.00 61.00 62.60 1tv4 s PRO 436 Cb -0.11 -1.90 -0.01 0.00 0.04 0.00 0.00 34.50 32.52 1tv4 s PRO 436 CO 0.02 -1.48 1.01 0.95 0.04 0.00 0.00 177.00 177.54 1tv4 s THR 437 N -1.95 4.09 0.40 1.26 -4.23 -0.52 -4.75 115.64 109.93 1tv4 s THR 437 Ca 0.73 0.51 0.08 0.00 -1.18 0.00 0.00 61.69 61.84 1tv4 s THR 437 Cb -0.27 -3.65 0.29 0.00 1.34 0.00 0.00 72.50 70.21 1tv4 s THR 437 CO 0.40 -0.81 2.00 -0.08 -0.54 0.00 0.00 174.62 175.59 1tv4 h GLU 438 N -0.37 0.58 -0.10 3.99 4.57 -1.95 -1.46 114.58 119.85 1tv4 h GLU 438 Ca -0.45 -0.03 0.04 0.00 -1.18 0.00 0.00 59.36 57.73 1tv4 h GLU 438 Cb 1.23 -0.13 -0.04 0.00 -0.16 0.00 0.00 28.75 29.64 1tv4 h GLU 438 CO 0.62 0.38 -0.14 1.49 -1.18 0.00 0.00 179.01 180.18 1tv4 h GLU 439 N 0.60 -0.18 -0.53 1.92 4.81 -1.94 -0.38 114.58 118.87 1tv4 h GLU 439 Ca 0.25 0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.44 1tv4 h GLU 439 Cb 0.23 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 1tv4 h GLU 439 CO -0.07 -0.12 0.13 -0.92 -0.73 0.00 0.00 179.01 177.30 1tv4 h TYR 440 N -0.19 0.90 -0.91 0.92 5.03 -1.61 -2.33 116.97 118.77 1tv4 h TYR 440 Ca 0.08 -0.11 0.07 0.00 2.58 0.00 0.00 58.73 61.36 1tv4 h TYR 440 Cb 0.31 -0.25 -0.06 0.00 1.55 0.00 0.00 36.73 38.27 1tv4 h TYR 440 CO -0.25 0.78 0.59 0.52 -1.32 0.00 0.00 178.16 178.49 1tv4 h MET 441 N 0.75 0.98 -0.44 1.82 2.86 -0.81 0.22 114.93 120.31 1tv4 h MET 441 Ca 0.17 -0.06 -0.14 0.00 -2.06 0.00 0.00 59.70 57.61 1tv4 h MET 441 Cb 0.34 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 31.77 1tv4 h MET 441 CO 0.00 0.65 -0.26 1.96 1.06 0.00 0.00 176.91 180.32 1tv4 h GLN 442 N 1.01 0.96 -0.52 1.72 1.08 -0.80 -0.85 115.11 117.71 1tv4 h GLN 442 Ca 0.40 -0.44 -0.02 0.00 -1.45 0.00 0.00 58.65 57.14 1tv4 h GLN 442 Cb 0.25 -0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.64 1tv4 h GLN 442 CO -0.16 1.11 0.23 0.28 -0.95 0.00 0.00 178.83 179.34 1tv4 h VAL 443 N 0.79 1.21 -0.23 -0.54 2.07 -0.76 -2.09 116.25 116.70 1tv4 h VAL 443 Ca 0.09 -0.61 0.03 0.00 0.82 0.00 0.00 66.70 67.03 1tv4 h VAL 443 Cb 0.85 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 31.24 1tv4 h VAL 443 CO 0.07 0.24 0.06 0.22 0.02 0.00 0.00 177.57 178.18 1tv4 h TYR 444 N 0.69 0.11 -0.98 1.57 3.20 -0.37 -2.08 116.97 119.11 1tv4 h TYR 444 Ca 0.18 0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.10 1tv4 h TYR 444 Cb 0.16 -0.01 -0.06 0.00 1.54 0.00 0.00 36.73 38.35 1tv4 h TYR 444 CO -0.00 0.04 0.64 -0.44 -1.64 0.00 0.00 178.16 176.77 1tv4 h ASP 445 N 0.16 1.07 -0.66 -2.11 3.32 -0.94 -0.98 116.42 116.28 1tv4 h ASP 445 Ca 0.10 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 1tv4 h ASP 445 Cb 0.09 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.36 1tv4 h ASP 445 CO -0.12 0.73 0.33 1.23 -1.72 0.00 0.00 179.24 179.69 1tv4 h GLY 446 N 1.24 1.01 0.88 2.75 0.00 -0.85 -0.79 103.07 107.31 1tv4 h GLY 446 Ca 0.39 -0.49 -0.05 0.00 0.00 0.00 0.00 47.33 47.18 1tv4 h GLY 446 CO -0.13 0.47 -0.02 0.00 0.00 0.00 0.00 176.54 176.86 1tv4 h ALA 447 N 1.15 0.40 -0.87 3.60 0.00 -0.92 -2.58 119.26 120.04 1tv4 h ALA 447 Ca 0.23 -0.25 0.04 0.00 0.00 0.00 0.00 54.91 54.93 1tv4 h ALA 447 Cb 0.10 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 17.72 1tv4 h ALA 447 CO -0.03 0.17 0.56 -0.09 0.00 0.00 0.00 179.25 179.86 1tv4 h ARG 448 N 0.32 1.03 -0.51 0.00 2.43 -0.96 -1.64 114.38 115.05 1tv4 h ARG 448 Ca 0.08 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.16 1tv4 h ARG 448 Cb 0.47 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 29.77 1tv4 h ARG 448 CO 0.02 0.68 0.20 -0.22 -1.51 0.00 0.00 179.97 179.14 1tv4 h LYS 449 N 1.06 0.76 -0.51 0.20 1.63 -1.02 -1.02 116.57 117.67 1tv4 h LYS 449 Ca 0.36 -0.14 -0.04 0.00 -0.85 0.00 0.00 60.65 59.98 1tv4 h LYS 449 Cb 0.06 -0.12 -0.02 0.00 -0.60 0.00 0.00 32.23 31.54 1tv4 h LYS 449 CO -0.14 0.68 0.16 0.87 -3.45 0.00 0.00 179.45 177.57 1tv4 h LYS 450 N 0.68 0.76 -0.42 1.90 1.57 -1.03 -0.58 116.57 119.45 1tv4 h LYS 450 Ca 0.17 -0.13 -0.14 0.00 -1.87 0.00 0.00 60.65 58.68 1tv4 h LYS 450 Cb 0.20 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 1tv4 h LYS 450 CO -0.01 0.66 -0.28 -0.07 -0.57 0.00 0.00 179.45 179.18 1tv4 h LEU 451 N 0.74 0.94 -0.94 2.94 3.38 -0.96 -2.76 115.31 118.66 1tv4 h LEU 451 Ca 0.17 -0.38 -0.08 0.00 0.09 0.00 0.00 57.88 57.68 1tv4 h LEU 451 Cb 0.23 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1tv4 h LEU 451 CO -0.01 1.16 -0.10 -0.33 0.09 0.00 0.00 178.44 179.24 1tv4 h GLU 452 N 0.77 0.66 0.00 1.13 5.08 -0.62 -1.79 114.58 119.81 1tv4 h GLU 452 Ca 0.09 -0.20 -0.02 0.00 -1.00 0.00 0.00 59.36 58.23 1tv4 h GLU 452 Cb 0.85 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.03 1tv4 h GLU 452 CO 0.07 0.75 -0.08 -0.44 -1.00 0.00 0.00 179.01 178.31 1tv4 h ASP 453 N 0.61 0.00 0.63 1.42 3.32 -0.91 -0.87 116.42 120.62 1tv4 h ASP 453 Ca 0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 1tv4 h ASP 453 Cb 0.54 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.09 1tv4 h ASP 453 CO 0.03 0.08 -0.16 0.18 -1.72 0.00 0.00 179.24 177.66 1tv4 n LEU 454 N -3.42 0.28 0.00 1.55 4.77 -0.70 -4.91 117.00 114.57 1tv4 n LEU 454 Ca -0.01 0.19 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 1tv4 n LEU 454 Cb 0.24 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 1tv4 n LEU 454 CO 0.28 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.01 1tv4 n GLY 455 N 1.41 1.06 3.74 -0.72 0.00 -0.33 -4.83 105.19 105.53 1tv4 n GLY 455 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1tv4 n GLY 455 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tv4 s LEU 456 N 0.00 4.47 -0.28 0.99 1.43 -1.02 -5.00 118.68 119.27 1tv4 s LEU 456 Ca 0.00 2.25 -0.00 0.00 -1.03 0.00 0.00 54.13 55.35 1tv4 s LEU 456 Cb 0.00 -3.61 0.05 0.00 0.03 0.00 0.00 46.19 42.66 1tv4 s LEU 456 CO 0.00 -0.32 -0.05 -0.69 0.23 0.00 0.00 176.35 175.52 1tv4 s VAL 457 N -0.34 2.68 -2.00 -1.59 1.01 -1.26 -4.22 120.40 114.67 1tv4 s VAL 457 Ca 0.51 -1.45 0.20 0.00 0.00 0.00 0.00 61.98 61.24 1tv4 s VAL 457 Cb -0.33 -2.54 0.57 0.00 0.00 0.00 0.00 36.38 34.09 1tv4 s VAL 457 CO 0.38 -0.06 1.59 0.49 0.00 0.00 0.00 175.10 177.50