#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1be3 s ASP 2 N 0.00 6.09 0.62 -3.46 1.01 -1.26 -5.05 116.67 114.61 1be3 s ASP 2 Ca 0.00 0.28 -0.18 0.00 0.71 0.00 0.00 52.55 53.36 1be3 s ASP 2 Cb 0.00 -2.01 -0.04 0.00 1.01 0.00 0.00 42.92 41.88 1be3 s ASP 2 CO 0.00 0.28 0.90 0.18 0.21 0.00 0.00 175.17 176.73 1be3 n LEU 3 N 2.86 3.32 -4.23 1.23 4.77 -1.26 -4.93 117.00 118.76 1be3 n LEU 3 Ca -0.18 0.77 -0.32 0.00 -0.03 0.00 0.00 56.01 56.25 1be3 n LEU 3 Cb 0.53 -1.36 -0.17 0.00 -2.33 0.00 0.00 43.42 40.09 1be3 n LEU 3 CO 0.34 -2.07 -0.56 -1.83 -1.33 0.00 0.00 177.39 171.94 1be3 s GLU 4 N -2.77 3.02 -0.35 3.23 -1.05 -1.26 -4.93 118.70 114.59 1be3 s GLU 4 Ca 0.75 -0.88 -0.03 0.00 -0.15 0.00 0.00 54.97 54.67 1be3 s GLU 4 Cb -0.41 -2.30 0.11 0.00 -0.44 0.00 0.00 34.13 31.10 1be3 s GLU 4 CO 0.48 0.19 2.47 -0.11 0.95 0.00 0.00 175.26 179.24 1be3 n LEU 5 N 3.48 6.37 0.21 1.83 7.94 -1.26 -4.70 117.00 130.88 1be3 n LEU 5 Ca -0.19 -3.62 0.14 0.00 -1.11 0.00 0.00 56.01 51.24 1be3 n LEU 5 Cb 0.53 -1.16 0.76 0.00 0.53 0.00 0.00 43.42 44.08 1be3 n LEU 5 CO 0.28 1.48 0.93 1.12 -1.11 0.00 0.00 177.39 180.09 1be3 h HIS 6 N 2.25 0.00 -1.12 1.96 2.07 -1.91 -3.36 115.15 115.04 1be3 h HIS 6 Ca 0.32 0.00 0.33 0.00 -2.85 0.00 0.00 60.37 58.17 1be3 h HIS 6 Cb 0.87 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 30.80 1be3 h HIS 6 CO 1.16 0.00 1.20 -1.35 -3.07 0.00 0.00 177.93 175.86 1be3 h PRO 7 N 0.00 0.00 -2.88 5.12 0.11 -2.01 -3.45 132.00 128.88 1be3 h PRO 7 Ca 0.00 0.00 -0.36 0.00 0.11 0.00 0.00 66.00 65.75 1be3 h PRO 7 Cb 0.01 0.00 0.03 0.00 0.11 0.00 0.00 31.00 31.15 1be3 h PRO 7 CO 0.00 0.00 -0.05 -2.30 -0.21 0.00 0.00 178.00 175.44 1be3 n PRO 8 N -3.38 0.00 -3.19 1.05 -0.01 -1.26 -4.93 135.00 123.29 1be3 n PRO 8 Ca 0.25 0.00 -0.22 0.00 -0.01 0.00 0.00 63.50 63.52 1be3 n PRO 8 Cb 1.54 -0.65 -0.05 0.00 -0.01 0.00 0.00 33.50 34.32 1be3 n PRO 8 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 175.50 175.92 1be3 n SER 9 N 0.79 1.20 -4.68 2.55 7.64 -1.26 -4.77 113.62 115.09 1be3 n SER 9 Ca 0.09 -2.99 -0.51 0.00 1.01 0.00 0.00 58.87 56.47 1be3 n SER 9 Cb 0.06 -0.63 -0.06 0.00 -1.01 0.00 0.00 64.21 62.58 1be3 n SER 9 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1be3 n TYR 10 N 0.73 2.13 -1.38 1.43 4.01 -1.26 -4.94 117.16 117.88 1be3 n TYR 10 Ca 0.24 0.29 -0.46 0.00 -0.16 0.00 0.00 57.90 57.82 1be3 n TYR 10 Cb 0.56 -2.54 -0.02 0.00 -0.31 0.00 0.00 39.34 37.03 1be3 n TYR 10 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1be3 n PRO 11 N 5.22 0.07 -3.95 -0.72 -0.04 -1.26 -4.98 135.00 129.34 1be3 n PRO 11 Ca 0.22 0.03 -0.08 0.00 -0.04 0.00 0.00 63.50 63.63 1be3 n PRO 11 Cb 0.23 -1.05 -0.04 0.00 -0.04 0.00 0.00 33.50 32.60 1be3 n PRO 11 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1be3 s TRP 12 N -1.20 0.18 -0.80 0.54 0.52 -1.26 -5.03 118.94 111.88 1be3 s TRP 12 Ca 0.62 -0.57 0.22 0.00 0.02 0.00 0.00 56.10 56.39 1be3 s TRP 12 Cb -0.83 0.37 -0.10 0.00 -1.15 0.00 0.00 33.47 31.76 1be3 s TRP 12 CO 0.58 -1.09 0.93 -1.13 0.02 0.00 0.00 176.95 176.27 1be3 n SER 13 N -0.43 0.73 -1.43 2.95 3.41 -1.26 -3.96 113.62 113.64 1be3 n SER 13 Ca -0.02 -0.63 -0.04 0.00 -0.26 0.00 0.00 58.87 57.92 1be3 n SER 13 Cb 0.61 1.00 0.10 0.00 -0.26 0.00 0.00 64.21 65.66 1be3 n SER 13 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1be3 n HIS 14 N -1.69 0.95 0.10 7.33 -0.00 -1.26 -4.26 115.22 116.39 1be3 n HIS 14 Ca 0.03 -1.61 -0.03 0.00 -0.00 0.00 0.00 57.72 56.10 1be3 n HIS 14 Cb 0.38 -0.26 0.02 0.00 -0.00 0.00 0.00 29.99 30.13 1be3 n HIS 14 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.34 176.25 1be3 h ARG 15 N 1.53 0.00 -6.97 -1.40 2.43 -1.86 -3.46 114.38 104.66 1be3 h ARG 15 Ca 0.05 0.00 -0.48 0.00 -0.81 0.00 0.00 59.98 58.74 1be3 h ARG 15 Cb 1.34 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.89 1be3 h ARG 15 CO 0.26 0.78 0.22 0.20 -1.51 0.00 0.00 179.97 179.92 1be3 s GLY 16 N -4.58 2.08 0.23 2.80 0.00 -1.26 -4.97 107.32 101.62 1be3 s GLY 16 Ca 0.01 0.02 -0.07 0.00 0.00 0.00 0.00 44.72 44.68 1be3 s GLY 16 CO 0.78 0.25 1.70 1.41 0.00 0.00 0.00 173.10 177.24 1be3 h LEU 17 N 1.34 0.06 0.00 0.66 3.38 -2.01 -0.77 115.31 117.98 1be3 h LEU 17 Ca -0.47 0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.62 1be3 h LEU 17 Cb 1.18 0.16 0.00 0.00 0.09 0.00 0.00 40.66 42.09 1be3 h LEU 17 CO 0.63 0.01 -0.68 -0.07 0.09 0.00 0.00 178.44 178.42 1be3 h LEU 18 N 0.30 0.00 -9.60 1.67 3.38 -1.94 -3.46 115.31 105.67 1be3 h LEU 18 Ca 0.38 -0.14 -0.52 0.00 0.09 0.00 0.00 57.88 57.68 1be3 h LEU 18 Cb 0.60 0.00 0.05 0.00 0.09 0.00 0.00 40.66 41.40 1be3 h LEU 18 CO -0.45 0.07 1.05 -0.44 0.09 0.00 0.00 178.44 178.76 1be3 s SER 19 N -4.65 6.40 0.39 -0.43 0.01 -0.30 -4.94 113.70 110.19 1be3 s SER 19 Ca 0.05 2.82 0.08 0.00 1.31 0.00 0.00 55.95 60.21 1be3 s SER 19 Cb 0.12 -2.59 -0.04 0.00 0.21 0.00 0.00 66.02 63.72 1be3 s SER 19 CO 0.73 -0.98 0.19 -0.94 0.41 0.00 0.00 173.24 172.66 1be3 s SER 20 N 1.77 4.58 0.44 2.44 1.04 -1.26 -4.71 113.70 117.99 1be3 s SER 20 Ca 0.77 -0.94 -0.25 0.00 0.48 0.00 0.00 55.95 56.01 1be3 s SER 20 Cb -0.48 -0.56 -0.08 0.00 0.10 0.00 0.00 66.02 65.00 1be3 s SER 20 CO 0.34 -0.48 1.34 -0.76 0.98 0.00 0.00 173.24 174.65 1be3 s LEU 21 N -3.92 4.14 -0.74 2.42 1.43 -1.26 -4.40 118.68 116.36 1be3 s LEU 21 Ca 0.41 2.73 -0.18 0.00 -1.03 0.00 0.00 54.13 56.06 1be3 s LEU 21 Cb 0.01 -3.97 0.13 0.00 0.03 0.00 0.00 46.19 42.40 1be3 s LEU 21 CO 0.23 -1.02 0.84 -0.62 0.23 0.00 0.00 176.35 176.01 1be3 s ASP 22 N -0.72 6.43 0.35 2.29 -1.08 -1.26 -4.95 116.67 117.73 1be3 s ASP 22 Ca 0.60 -1.85 0.07 0.00 -0.52 0.00 0.00 52.55 50.85 1be3 s ASP 22 Cb -0.39 -2.31 0.76 0.00 -1.46 0.00 0.00 42.92 39.52 1be3 s ASP 22 CO 0.50 -1.00 1.89 0.45 0.52 0.00 0.00 175.17 177.54 1be3 h HIS 23 N 8.80 0.84 -0.62 -5.34 3.86 -1.93 -0.01 115.15 120.76 1be3 h HIS 23 Ca -0.09 0.02 0.12 0.00 -1.16 0.00 0.00 60.37 59.27 1be3 h HIS 23 Cb 1.06 -0.27 -0.12 0.00 1.06 0.00 0.00 27.41 29.14 1be3 h HIS 23 CO 0.97 0.36 -0.22 1.15 0.86 0.00 0.00 177.93 181.04 1be3 h THR 24 N 0.75 0.28 -0.73 2.45 2.02 -1.92 1.55 112.91 117.32 1be3 h THR 24 Ca 0.41 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.71 1be3 h THR 24 Cb 0.55 0.28 -0.08 0.00 -1.74 0.00 0.00 68.15 67.16 1be3 h THR 24 CO -0.18 0.00 0.32 -1.28 0.37 0.00 0.00 175.52 174.75 1be3 h SER 25 N -0.07 0.35 -0.11 4.18 0.87 -1.41 0.16 113.55 117.53 1be3 h SER 25 Ca 0.28 0.09 0.03 0.00 -1.23 0.00 0.00 61.79 60.96 1be3 h SER 25 Cb 0.51 0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 62.48 1be3 h SER 25 CO -0.67 0.17 -0.09 0.40 -0.53 0.00 0.00 176.83 176.11 1be3 h ILE 26 N 0.50 0.74 0.05 2.23 2.04 0.18 0.13 117.51 123.39 1be3 h ILE 26 Ca 0.38 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.26 1be3 h ILE 26 Cb 0.52 0.74 -0.05 0.00 -0.74 0.00 0.00 36.82 37.29 1be3 h ILE 26 CO -0.35 0.00 -0.47 -0.09 0.00 0.00 0.00 178.15 177.24 1be3 h ARG 27 N -0.10 -0.60 -0.03 2.37 2.43 0.43 0.17 114.38 119.04 1be3 h ARG 27 Ca 0.07 0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 1be3 h ARG 27 Cb 0.21 0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.89 1be3 h ARG 27 CO -0.17 -0.40 -0.04 0.00 -1.51 0.00 0.00 179.97 177.84 1be3 h ARG 28 N -0.63 -0.03 -0.47 0.20 3.08 -0.70 -1.95 114.38 113.89 1be3 h ARG 28 Ca 0.00 0.00 0.14 0.00 0.07 0.00 0.00 59.98 60.19 1be3 h ARG 28 Cb 0.65 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.69 1be3 h ARG 28 CO -0.28 -0.02 0.70 0.78 -1.07 0.00 0.00 179.97 180.08 1be3 h GLY 29 N -0.03 0.00 0.58 0.04 0.00 -0.77 0.76 103.07 103.65 1be3 h GLY 29 Ca 0.01 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1be3 h GLY 29 CO -0.05 0.00 -0.05 -2.75 0.00 0.00 0.00 176.54 173.70 1be3 h PHE 30 N 0.00 -0.12 -0.16 5.60 3.57 -0.16 -2.52 116.94 123.15 1be3 h PHE 30 Ca 0.22 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.76 1be3 h PHE 30 Cb 1.63 0.04 -0.05 0.00 2.79 0.00 0.00 35.95 40.36 1be3 h PHE 30 CO 0.00 0.28 -0.14 1.96 -2.23 0.00 0.00 178.31 178.18 1be3 h GLN 31 N -0.55 -0.15 -0.87 1.11 1.08 -0.67 0.18 115.11 115.24 1be3 h GLN 31 Ca -0.01 0.01 0.15 0.00 -1.45 0.00 0.00 58.65 57.34 1be3 h GLN 31 Cb 0.45 0.03 -0.15 0.00 -0.05 0.00 0.00 27.48 27.77 1be3 h GLN 31 CO 0.02 -0.10 -0.34 0.28 -0.95 0.00 0.00 178.83 177.74 1be3 h VAL 32 N -0.16 0.07 -0.28 -0.54 2.07 -1.50 1.11 116.25 117.03 1be3 h VAL 32 Ca 0.10 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.61 1be3 h VAL 32 Cb 0.31 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.13 1be3 h VAL 32 CO -0.25 0.00 0.13 0.22 0.02 0.00 0.00 177.57 177.69 1be3 h TYR 33 N -0.04 0.40 -0.81 1.57 3.20 -0.65 -0.13 116.97 120.51 1be3 h TYR 33 Ca 0.34 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.18 1be3 h TYR 33 Cb 0.60 -0.12 -0.04 0.00 1.54 0.00 0.00 36.73 38.70 1be3 h TYR 33 CO -0.77 0.38 0.48 -0.22 -1.64 0.00 0.00 178.16 176.39 1be3 h LYS 34 N 0.31 1.11 0.00 1.82 3.64 0.40 0.62 116.57 124.47 1be3 h LYS 34 Ca 0.09 -0.10 -0.17 0.00 -1.27 0.00 0.00 60.65 59.20 1be3 h LYS 34 Cb 0.13 -0.23 -0.03 0.00 -0.41 0.00 0.00 32.23 31.69 1be3 h LYS 34 CO -0.01 0.79 -1.22 1.04 -2.27 0.00 0.00 179.45 177.77 1be3 n GLN 35 N -4.37 0.53 0.19 1.90 1.13 0.51 -4.22 117.38 113.04 1be3 n GLN 35 Ca 0.09 0.45 0.06 0.00 -1.94 0.00 0.00 57.00 55.66 1be3 n GLN 35 Cb 0.07 -1.64 0.32 0.00 0.11 0.00 0.00 30.24 29.10 1be3 n GLN 35 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 1be3 h VAL 36 N -1.00 0.87 0.00 5.09 2.07 -1.10 -3.42 116.25 118.76 1be3 h VAL 36 Ca -0.25 -1.55 -0.06 0.00 0.82 0.00 0.00 66.70 65.65 1be3 h VAL 36 Cb 1.07 1.95 -0.01 0.00 -1.52 0.00 0.00 31.29 32.78 1be3 h VAL 36 CO -0.15 0.37 -1.22 0.00 0.02 0.00 0.00 177.57 176.59 1be3 n SER 38 N -3.03 0.08 -0.14 0.00 3.41 0.18 -0.79 113.62 113.32 1be3 n SER 38 Ca -0.07 0.65 -0.04 0.00 -0.26 0.00 0.00 58.87 59.15 1be3 n SER 38 Cb 0.56 -0.32 0.03 0.00 -0.26 0.00 0.00 64.21 64.22 1be3 n SER 38 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1be3 h SER 39 N 0.00 -0.38 0.00 4.04 4.64 -1.84 -3.39 113.55 116.62 1be3 h SER 39 Ca 0.46 0.13 -0.05 0.00 -0.47 0.00 0.00 61.79 61.86 1be3 h SER 39 Cb 1.58 0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 63.93 1be3 h SER 39 CO -0.17 -0.13 -1.21 0.00 -0.87 0.00 0.00 176.83 174.45 1be3 s HIS 41 N -2.07 3.44 0.62 0.00 3.76 -1.09 -4.72 115.29 115.23 1be3 s HIS 41 Ca -0.02 0.40 0.04 0.00 -0.15 0.00 0.00 55.06 55.33 1be3 s HIS 41 Cb 0.01 -1.90 0.09 0.00 1.11 0.00 0.00 32.58 31.89 1be3 s HIS 41 CO 0.12 0.62 0.86 -1.54 -0.85 0.00 0.00 174.74 173.95 1be3 s SER 42 N -0.90 4.84 -0.44 1.40 1.04 -1.26 -4.33 113.70 114.04 1be3 s SER 42 Ca 0.14 -0.51 0.06 0.00 0.48 0.00 0.00 55.95 56.12 1be3 s SER 42 Cb -0.12 -0.04 0.21 0.00 0.10 0.00 0.00 66.02 66.17 1be3 s SER 42 CO 0.03 -1.50 0.59 0.23 0.98 0.00 0.00 173.24 173.57 1be3 n MET 43 N -2.48 0.53 -0.27 4.02 2.00 -1.26 -0.36 117.12 119.30 1be3 n MET 43 Ca 0.14 -2.65 -0.06 0.00 0.00 0.00 0.00 57.70 55.13 1be3 n MET 43 Cb 0.61 -1.46 0.06 0.00 0.00 0.00 0.00 33.22 32.43 1be3 n MET 43 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 175.97 175.53 1be3 h ASP 44 N 4.70 1.01 0.55 7.83 3.32 -1.97 -2.42 116.42 129.44 1be3 h ASP 44 Ca 0.08 -0.16 0.00 0.00 0.02 0.00 0.00 57.03 56.97 1be3 h ASP 44 Cb 0.97 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 40.26 1be3 h ASP 44 CO 0.31 0.89 0.00 -1.22 -1.72 0.00 0.00 179.24 177.50 1be3 n TYR 45 N -4.35 0.00 -2.76 4.55 4.01 -1.26 -4.66 117.16 112.69 1be3 n TYR 45 Ca 0.06 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.37 1be3 n TYR 45 Cb 0.17 -0.30 -0.03 0.00 -0.31 0.00 0.00 39.34 38.87 1be3 n TYR 45 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1be3 s VAL 46 N -2.59 4.39 0.34 -0.72 1.01 -0.91 -5.02 120.40 116.90 1be3 s VAL 46 Ca 0.26 0.88 -0.03 0.00 0.00 0.00 0.00 61.98 63.09 1be3 s VAL 46 Cb 0.19 -4.49 0.07 0.00 0.00 0.00 0.00 36.38 32.16 1be3 s VAL 46 CO 0.43 -0.89 0.46 0.00 0.00 0.00 0.00 175.10 175.11 1be3 n ALA 47 N 7.36 -0.23 1.26 5.51 0.00 -1.26 -1.73 120.51 131.42 1be3 n ALA 47 Ca 0.08 -0.75 0.03 0.00 0.00 0.00 0.00 53.44 52.80 1be3 n ALA 47 Cb 0.49 0.06 0.08 0.00 0.00 0.00 0.00 19.45 20.08 1be3 n ALA 47 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1be3 n TYR 48 N -2.31 0.29 -0.96 0.00 4.02 -1.25 -4.68 117.16 112.27 1be3 n TYR 48 Ca 0.07 -0.13 -0.39 0.00 -0.01 0.00 0.00 57.90 57.43 1be3 n TYR 48 Cb 0.24 -0.04 -0.06 0.00 -0.02 0.00 0.00 39.34 39.46 1be3 n TYR 48 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 176.86 178.74 1be3 n ARG 49 N 0.06 1.32 -0.09 -0.72 1.85 -1.26 -4.37 116.66 113.44 1be3 n ARG 49 Ca 0.06 -1.62 -0.08 0.00 -1.00 0.00 0.00 57.85 55.21 1be3 n ARG 49 Cb 0.21 -2.76 -0.16 0.00 -1.05 0.00 0.00 32.46 28.70 1be3 n ARG 49 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 1be3 n HIS 50 N 7.13 0.00 0.00 2.89 8.25 -1.26 -4.66 115.22 127.57 1be3 n HIS 50 Ca 0.47 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.93 1be3 n HIS 50 Cb 0.35 -0.96 0.00 0.00 1.12 0.00 0.00 29.99 30.50 1be3 n HIS 50 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1be3 n LEU 51 N -2.71 0.00 0.10 2.41 4.77 -1.23 0.48 117.00 120.83 1be3 n LEU 51 Ca -0.31 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 55.78 1be3 n LEU 51 Cb 1.11 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.21 1be3 n LEU 51 CO 0.43 0.00 0.03 0.58 -1.33 0.00 0.00 177.39 177.10 1be3 h VAL 52 N 0.00 0.01 0.00 4.08 2.07 -1.87 -0.72 116.25 119.82 1be3 h VAL 52 Ca 0.00 -1.02 0.00 0.00 0.82 0.00 0.00 66.70 66.50 1be3 h VAL 52 Cb 0.00 1.52 0.00 0.00 -1.52 0.00 0.00 31.29 31.29 1be3 h VAL 52 CO 0.00 0.01 -0.37 1.23 0.02 0.00 0.00 177.57 178.46 1be3 h GLY 53 N 3.99 0.00 0.00 2.17 0.00 -0.09 -3.34 103.07 105.81 1be3 h GLY 53 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1be3 h GLY 53 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.54 175.92 1be3 n VAL 54 N -2.51 0.00 -0.95 4.60 0.31 1.77 -4.92 118.33 116.63 1be3 n VAL 54 Ca 0.03 -0.30 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 1be3 n VAL 54 Cb 0.48 1.38 0.00 0.00 -0.91 0.00 0.00 33.84 34.79 1be3 n VAL 54 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1be3 s TYR 56 N -1.81 3.79 1.08 0.00 2.02 -0.66 -4.97 117.35 116.81 1be3 s TYR 56 Ca 0.00 1.73 -0.12 0.00 -0.37 0.00 0.00 57.07 58.31 1be3 s TYR 56 Cb 0.00 -3.01 0.24 0.00 -0.40 0.00 0.00 41.96 38.79 1be3 s TYR 56 CO 0.00 0.21 1.06 0.99 -1.57 0.00 0.00 175.55 176.25 1be3 s THR 57 N 0.02 2.07 0.22 -0.71 2.01 -1.26 -3.47 115.64 114.52 1be3 s THR 57 Ca 0.45 0.02 -0.09 0.00 0.31 0.00 0.00 61.69 62.39 1be3 s THR 57 Cb -0.23 -2.10 0.18 0.00 0.01 0.00 0.00 72.50 70.36 1be3 s THR 57 CO 0.28 -0.03 1.86 -0.08 -0.69 0.00 0.00 174.62 175.97 1be3 h GLU 58 N -2.37 1.11 -0.06 4.92 4.81 -1.96 0.25 114.58 121.28 1be3 h GLU 58 Ca -0.56 -0.10 -0.18 0.00 -0.13 0.00 0.00 59.36 58.39 1be3 h GLU 58 Cb 1.31 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 30.45 1be3 h GLU 58 CO 0.48 0.78 -0.74 -0.44 -0.73 0.00 0.00 179.01 178.36 1be3 h ASP 59 N 1.12 0.40 0.49 1.04 3.32 -1.98 0.51 116.42 121.32 1be3 h ASP 59 Ca 0.29 -0.27 -0.02 0.00 0.02 0.00 0.00 57.03 57.05 1be3 h ASP 59 Cb -0.05 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.39 1be3 h ASP 59 CO -0.06 1.00 -0.23 -0.08 -1.72 0.00 0.00 179.24 178.15 1be3 h GLU 60 N 0.22 -0.63 0.00 3.56 4.81 -1.82 -2.00 114.58 118.71 1be3 h GLU 60 Ca -0.03 0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.15 1be3 h GLU 60 Cb 1.32 0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.83 1be3 h GLU 60 CO 0.12 -0.42 -0.45 0.00 -0.73 0.00 0.00 179.01 177.53 1be3 h ALA 61 N -1.60 1.20 0.16 2.92 0.00 -0.56 -0.79 119.26 120.59 1be3 h ALA 61 Ca -0.07 -0.41 0.02 0.00 0.00 0.00 0.00 54.91 54.45 1be3 h ALA 61 Cb 0.50 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 1be3 h ALA 61 CO 0.11 0.57 -0.33 -0.22 0.00 0.00 0.00 179.25 179.37 1be3 h LYS 62 N 0.00 -0.56 -0.84 0.00 3.64 0.03 1.28 116.57 120.12 1be3 h LYS 62 Ca -0.00 0.04 0.02 0.00 -1.27 0.00 0.00 60.65 59.43 1be3 h LYS 62 Cb 0.83 0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 32.73 1be3 h LYS 62 CO 0.06 -0.38 0.55 0.00 -2.27 0.00 0.00 179.45 177.42 1be3 h ALA 63 N 0.02 1.44 -0.53 5.00 0.00 -0.81 0.60 119.26 124.97 1be3 h ALA 63 Ca 0.02 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 1be3 h ALA 63 Cb 0.60 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1be3 h ALA 63 CO -0.17 0.50 -0.03 1.25 0.00 0.00 0.00 179.25 180.80 1be3 h LEU 64 N 1.09 0.91 -0.28 0.00 5.85 -0.59 -2.73 115.31 119.55 1be3 h LEU 64 Ca 0.32 -0.25 -0.05 0.00 0.84 0.00 0.00 57.88 58.74 1be3 h LEU 64 Cb -0.06 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.72 1be3 h LEU 64 CO -0.08 0.98 -0.01 0.00 -0.34 0.00 0.00 178.44 178.98 1be3 h ALA 65 N 1.11 0.39 -0.47 1.25 0.00 0.34 -3.09 119.26 118.78 1be3 h ALA 65 Ca 0.15 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 54.84 1be3 h ALA 65 Cb 0.54 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 1be3 h ALA 65 CO 0.03 0.14 0.28 0.93 0.00 0.00 0.00 179.25 180.64 1be3 h GLU 66 N 0.29 0.55 -0.29 0.00 5.08 0.41 -1.28 114.58 119.34 1be3 h GLU 66 Ca 0.08 -0.03 -0.10 0.00 -1.00 0.00 0.00 59.36 58.30 1be3 h GLU 66 Cb 0.45 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 1be3 h GLU 66 CO 0.02 0.36 -0.26 1.05 -1.00 0.00 0.00 179.01 179.18 1be3 h GLU 67 N 0.57 0.57 -0.07 2.33 4.11 -1.60 0.50 114.58 120.99 1be3 h GLU 67 Ca 0.19 -0.23 -0.06 0.00 0.07 0.00 0.00 59.36 59.33 1be3 h GLU 67 Cb 0.01 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 1be3 h GLU 67 CO -0.08 0.78 -0.23 0.28 0.07 0.00 0.00 179.01 179.82 1be3 h VAL 68 N 0.50 1.20 0.00 -1.06 2.07 -1.32 -0.85 116.25 116.78 1be3 h VAL 68 Ca 0.07 -0.92 -0.04 0.00 0.82 0.00 0.00 66.70 66.62 1be3 h VAL 68 Cb 0.71 1.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.88 1be3 h VAL 68 CO 0.05 0.27 -0.21 1.05 0.02 0.00 0.00 177.57 178.76 1be3 h GLU 69 N 0.10 0.00 -0.20 1.57 4.11 -0.81 -0.46 114.58 118.90 1be3 h GLU 69 Ca 0.02 0.00 -0.11 0.00 0.07 0.00 0.00 59.36 59.34 1be3 h GLU 69 Cb 0.47 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.72 1be3 h GLU 69 CO 0.03 0.21 -0.30 -0.24 0.07 0.00 0.00 179.01 178.78 1be3 h VAL 70 N 0.00 1.33 0.13 -1.06 3.04 0.42 0.94 116.25 121.06 1be3 h VAL 70 Ca -0.00 -1.52 -0.36 0.00 -1.01 0.00 0.00 66.70 63.81 1be3 h VAL 70 Cb 1.15 1.84 -0.01 0.00 -2.01 0.00 0.00 31.29 32.25 1be3 h VAL 70 CO 0.03 0.47 -1.97 -0.61 -1.01 0.00 0.00 177.57 174.47 1be3 h GLN 71 N 0.22 0.28 0.00 4.17 4.15 -1.30 -3.38 115.11 119.25 1be3 h GLN 71 Ca 0.02 -0.48 0.00 0.00 0.77 0.00 0.00 58.65 58.96 1be3 h GLN 71 Cb 0.88 0.18 0.00 0.00 0.21 0.00 0.00 27.48 28.75 1be3 h GLN 71 CO 0.07 1.23 -1.17 -3.47 -1.93 0.00 0.00 178.83 173.55 1be3 n ASP 72 N -3.49 0.79 0.00 -0.69 -0.08 -0.23 -5.05 116.55 107.80 1be3 n ASP 72 Ca -0.31 -0.68 0.00 0.00 -1.51 0.00 0.00 54.79 52.29 1be3 n ASP 72 Cb 1.05 1.25 0.00 0.00 2.34 0.00 0.00 41.12 45.76 1be3 n ASP 72 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1be3 n GLY 73 N 1.43 0.00 0.00 0.27 0.00 0.32 -3.79 105.19 103.43 1be3 n GLY 73 Ca 0.02 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.06 1be3 n GLY 73 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1be3 n PRO 74 N 0.00 0.10 0.24 1.61 -0.02 -1.26 -1.42 135.00 134.25 1be3 n PRO 74 Ca 0.00 0.15 0.10 0.00 -2.02 0.00 0.00 63.50 61.74 1be3 n PRO 74 Cb 0.00 -1.50 0.59 0.00 -0.02 0.00 0.00 33.50 32.57 1be3 n PRO 74 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1be3 h ASN 75 N 0.00 0.00 -0.21 2.55 4.21 -1.76 1.48 115.58 121.85 1be3 h ASN 75 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1be3 h ASN 75 Cb 0.03 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.23 1be3 h ASN 75 CO 0.00 0.19 0.00 1.21 -1.29 0.00 0.00 177.43 177.54 1be3 n GLU 76 N -3.63 2.09 -0.03 0.81 2.13 -0.51 -4.07 120.64 117.43 1be3 n GLU 76 Ca -0.01 -1.63 -0.02 0.00 0.66 0.00 0.00 57.16 56.16 1be3 n GLU 76 Cb 0.33 -1.46 -0.07 0.00 0.27 0.00 0.00 31.44 30.51 1be3 n GLU 76 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 1be3 n ASP 77 N 0.88 2.99 0.00 4.31 -0.08 0.77 -4.93 116.55 120.49 1be3 n ASP 77 Ca 0.17 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.45 1be3 n ASP 77 Cb 0.47 0.86 0.00 0.00 2.34 0.00 0.00 41.12 44.79 1be3 n ASP 77 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1be3 n GLY 78 N 2.39 1.44 3.44 0.27 0.00 0.44 -5.04 105.19 108.12 1be3 n GLY 78 Ca -0.11 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.48 1be3 n GLY 78 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1be3 n GLU 79 N -0.34 3.36 0.00 1.61 1.02 0.25 -4.91 120.64 121.63 1be3 n GLU 79 Ca 0.00 -3.74 0.00 0.00 -0.02 0.00 0.00 57.16 53.40 1be3 n GLU 79 Cb 0.00 -3.10 0.00 0.00 -0.02 0.00 0.00 31.44 28.32 1be3 n GLU 79 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 1be3 n MET 80 N 5.91 0.00 -1.46 3.49 2.81 -1.26 -0.99 117.12 125.63 1be3 n MET 80 Ca 0.39 0.44 -0.27 0.00 -1.81 0.00 0.00 57.70 56.45 1be3 n MET 80 Cb 0.43 -0.69 -0.03 0.00 -0.71 0.00 0.00 33.22 32.22 1be3 n MET 80 CO 0.00 0.00 0.00 1.97 1.51 0.00 0.00 175.97 179.45 1be3 n PHE 81 N -2.20 1.80 -4.23 2.03 -1.74 -1.26 -4.54 117.46 107.32 1be3 n PHE 81 Ca 0.00 -2.03 -0.32 0.00 -0.56 0.00 0.00 57.45 54.54 1be3 n PHE 81 Cb 0.00 -1.31 -0.08 0.00 1.52 0.00 0.00 39.48 39.61 1be3 n PHE 81 CO 0.00 0.00 0.00 1.41 -0.56 0.00 0.00 176.76 177.61 1be3 s MET 82 N -2.07 2.75 0.00 3.97 1.75 -0.16 -5.09 119.30 120.45 1be3 s MET 82 Ca 0.55 -0.66 0.00 0.00 -1.25 0.00 0.00 55.69 54.33 1be3 s MET 82 Cb 0.38 -2.65 0.00 0.00 2.84 0.00 0.00 34.83 35.39 1be3 s MET 82 CO -0.21 0.60 0.00 0.54 -0.65 0.00 0.00 175.02 175.30 1be3 n ARG 83 N 1.15 0.00 -1.20 4.11 1.74 -1.26 -4.36 116.66 116.84 1be3 n ARG 83 Ca -0.13 0.00 -0.38 0.00 -0.77 0.00 0.00 57.85 56.57 1be3 n ARG 83 Cb 0.52 0.00 0.03 0.00 -1.02 0.00 0.00 32.46 32.00 1be3 n ARG 83 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 1be3 n PRO 84 N 0.00 0.08 0.00 5.56 -0.01 -1.26 -4.57 135.00 134.80 1be3 n PRO 84 Ca 0.00 0.04 0.00 0.00 -0.01 0.00 0.00 63.50 63.53 1be3 n PRO 84 Cb 0.00 -1.20 0.00 0.00 -0.01 0.00 0.00 33.50 32.29 1be3 n PRO 84 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 1be3 n GLY 85 N 2.54 2.48 3.65 -1.23 0.00 -1.26 -5.03 105.19 106.34 1be3 n GLY 85 Ca 0.06 -0.72 -0.38 0.00 0.00 0.00 0.00 46.02 44.98 1be3 n GLY 85 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1be3 n LYS 86 N 0.00 1.06 -0.00 1.61 5.02 -1.26 -4.82 118.16 119.76 1be3 n LYS 86 Ca 0.00 0.40 0.00 0.00 -2.02 0.00 0.00 58.31 56.70 1be3 n LYS 86 Cb 0.00 -2.28 -0.00 0.00 -0.02 0.00 0.00 35.03 32.73 1be3 n LYS 86 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1be3 n LEU 87 N -0.94 0.00 -0.02 -0.35 4.32 -1.26 -4.56 117.00 114.19 1be3 n LEU 87 Ca 0.13 -0.11 0.12 0.00 -0.02 0.00 0.00 56.01 56.13 1be3 n LEU 87 Cb 0.47 0.00 0.67 0.00 -1.62 0.00 0.00 43.42 42.94 1be3 n LEU 87 CO 0.50 0.00 0.93 -0.24 -1.22 0.00 0.00 177.39 177.36 1be3 n SER 88 N -1.40 0.07 -4.76 -1.43 2.88 -1.26 -4.15 113.62 103.57 1be3 n SER 88 Ca -0.00 -1.30 -0.40 0.00 -1.33 0.00 0.00 58.87 55.84 1be3 n SER 88 Cb 0.00 -0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.40 1be3 n SER 88 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 1be3 s ASP 89 N -1.72 7.47 0.57 -3.46 1.01 -1.26 -4.93 116.67 114.35 1be3 s ASP 89 Ca 0.34 1.74 -0.07 0.00 0.71 0.00 0.00 52.55 55.28 1be3 s ASP 89 Cb 0.16 -2.55 -0.01 0.00 1.01 0.00 0.00 42.92 41.53 1be3 s ASP 89 CO 0.27 0.13 0.90 -0.31 0.21 0.00 0.00 175.17 176.37 1be3 s TYR 90 N -0.85 3.41 0.16 4.23 1.51 -1.26 -3.74 117.35 120.81 1be3 s TYR 90 Ca 0.39 0.83 -0.33 0.00 -1.01 0.00 0.00 57.07 56.95 1be3 s TYR 90 Cb -0.24 -2.63 -0.16 0.00 -0.11 0.00 0.00 41.96 38.82 1be3 s TYR 90 CO 0.28 -0.67 1.13 1.19 -1.11 0.00 0.00 175.55 176.37 1be3 n PHE 91 N -2.55 1.16 -1.99 2.71 3.01 -0.71 -4.82 117.46 114.27 1be3 n PHE 91 Ca 0.04 0.72 -0.42 0.00 1.01 0.00 0.00 57.45 58.80 1be3 n PHE 91 Cb 0.56 -2.25 -0.03 0.00 -0.01 0.00 0.00 39.48 37.75 1be3 n PHE 91 CO 0.00 0.00 0.00 -2.14 1.01 0.00 0.00 176.76 175.63 1be3 s PRO 92 N -0.37 4.24 -0.13 -1.08 0.02 -1.26 -4.68 135.00 131.74 1be3 s PRO 92 Ca 0.74 2.29 -0.29 0.00 0.02 0.00 0.00 61.00 63.76 1be3 s PRO 92 Cb -0.89 -3.17 -0.04 0.00 0.02 0.00 0.00 34.50 30.42 1be3 s PRO 92 CO 0.53 -0.56 1.64 0.15 -0.33 0.00 0.00 177.00 178.43 1be3 s LYS 93 N 1.05 3.99 0.41 5.54 1.02 -1.26 -4.75 119.74 125.74 1be3 s LYS 93 Ca 0.68 1.94 0.25 0.00 0.02 0.00 0.00 55.97 58.86 1be3 s LYS 93 Cb -0.42 -4.01 1.30 0.00 -0.52 0.00 0.00 37.83 34.18 1be3 s LYS 93 CO 0.32 -1.06 1.66 -1.35 -0.92 0.00 0.00 175.35 173.99 1be3 h PRO 94 N 10.14 0.18 -4.17 -1.68 0.11 -1.85 -3.42 132.00 131.32 1be3 h PRO 94 Ca -0.36 -0.01 -0.15 0.00 0.11 0.00 0.00 66.00 65.59 1be3 h PRO 94 Cb 1.17 -0.04 -0.17 0.00 0.11 0.00 0.00 31.00 32.06 1be3 h PRO 94 CO 0.97 0.12 -0.69 0.71 -0.21 0.00 0.00 178.00 178.90 1be3 s TYR 95 N -5.40 0.44 0.53 0.65 1.51 -1.26 -4.97 117.35 108.85 1be3 s TYR 95 Ca -0.08 -0.84 0.24 0.00 -1.01 0.00 0.00 57.07 55.38 1be3 s TYR 95 Cb 0.29 -0.32 1.37 0.00 -0.11 0.00 0.00 41.96 43.19 1be3 s TYR 95 CO 0.81 -0.29 2.01 -1.35 -1.11 0.00 0.00 175.55 175.62 1be3 h PRO 96 N 3.74 0.01 -1.33 -1.71 0.11 -1.92 -3.43 132.00 127.49 1be3 h PRO 96 Ca -0.33 -0.00 0.13 0.00 0.11 0.00 0.00 66.00 65.91 1be3 h PRO 96 Cb 1.17 -0.00 -0.30 0.00 0.11 0.00 0.00 31.00 31.98 1be3 h PRO 96 CO 0.56 0.01 0.67 1.21 -0.21 0.00 0.00 178.00 180.23 1be3 s ASN 97 N -6.28 -0.25 0.00 -2.05 2.47 -1.26 -5.07 114.94 102.49 1be3 s ASN 97 Ca -0.05 0.48 0.00 0.00 0.42 0.00 0.00 52.86 53.70 1be3 s ASN 97 Cb 0.19 0.53 0.00 0.00 -1.45 0.00 0.00 41.25 40.52 1be3 s ASN 97 CO 0.73 -0.08 0.00 -2.65 -3.72 0.00 0.00 177.10 171.38 1be3 n PRO 98 N 2.01 0.00 -0.23 0.43 -0.01 -1.26 -0.59 135.00 135.35 1be3 n PRO 98 Ca -0.12 0.00 0.02 0.00 -0.01 0.00 0.00 63.50 63.40 1be3 n PRO 98 Cb 0.56 0.00 0.12 0.00 -0.01 0.00 0.00 33.50 34.17 1be3 n PRO 98 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 175.50 176.42 1be3 h GLU 99 N 0.00 0.08 0.00 -0.52 4.39 -1.98 -0.98 114.58 115.57 1be3 h GLU 99 Ca 0.00 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1be3 h GLU 99 Cb 0.00 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.63 1be3 h GLU 99 CO 0.00 0.05 0.00 0.00 -1.16 0.00 0.00 179.01 177.90 1be3 n ALA 100 N -2.93 -0.21 0.00 3.43 0.00 0.24 -2.77 120.51 118.28 1be3 n ALA 100 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1be3 n ALA 100 Cb 0.40 0.14 0.00 0.00 0.00 0.00 0.00 19.45 19.99 1be3 n ALA 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1be3 n ALA 101 N -1.74 0.00 0.18 0.00 0.00 -0.97 0.51 120.51 118.49 1be3 n ALA 101 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.47 1be3 n ALA 101 Cb 0.00 0.00 0.32 0.00 0.00 0.00 0.00 19.45 19.77 1be3 n ALA 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1be3 h ARG 102 N 0.00 0.00 -0.43 0.00 3.08 -1.05 -3.05 114.38 112.93 1be3 h ARG 102 Ca 0.00 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.92 1be3 h ARG 102 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 1be3 h ARG 102 CO 0.00 0.43 -0.25 0.00 -1.07 0.00 0.00 179.97 179.08 1be3 h ALA 103 N 1.57 0.61 0.00 0.04 0.00 1.26 1.41 119.26 124.16 1be3 h ALA 103 Ca -0.00 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1be3 h ALA 103 Cb 0.81 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1be3 h ALA 103 CO 0.06 0.62 0.00 0.00 0.00 0.00 0.00 179.25 179.93 1be3 h ALA 104 N 0.82 1.00 0.00 0.00 0.00 -1.38 -1.88 119.26 117.82 1be3 h ALA 104 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1be3 h ALA 104 Cb 0.83 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1be3 h ALA 104 CO 0.07 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.41 1be3 n ASN 105 N -2.44 1.38 -2.85 0.00 3.02 -1.10 -5.05 115.26 108.21 1be3 n ASN 105 Ca 0.01 -1.65 -0.01 0.00 -0.03 0.00 0.00 54.58 52.90 1be3 n ASN 105 Cb 0.18 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.35 1be3 n ASN 105 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1be3 n ASN 106 N -0.33 -7.09 0.00 6.41 4.05 0.36 -3.64 115.26 115.02 1be3 n ASN 106 Ca 0.00 -0.02 0.00 0.00 0.45 0.00 0.00 54.58 55.01 1be3 n ASN 106 Cb 0.30 -4.79 0.00 0.00 1.23 0.00 0.00 39.78 36.52 1be3 n ASN 106 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1be3 n GLY 107 N -1.58 3.00 3.90 8.20 0.00 0.39 -4.97 105.19 114.13 1be3 n GLY 107 Ca 0.01 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.75 1be3 n GLY 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1be3 s ALA 108 N -1.41 3.32 -0.34 4.61 0.00 -1.24 -4.93 121.76 121.76 1be3 s ALA 108 Ca 0.00 -0.43 -0.01 0.00 0.00 0.00 0.00 51.96 51.53 1be3 s ALA 108 Cb 0.00 -2.71 0.11 0.00 0.00 0.00 0.00 23.12 20.53 1be3 s ALA 108 CO 0.00 -0.48 0.15 -1.17 0.00 0.00 0.00 175.76 174.26 1be3 s LEU 109 N -4.88 1.72 -0.52 0.00 2.96 -1.26 -3.58 118.68 113.12 1be3 s LEU 109 Ca 0.50 -1.85 -0.35 0.00 -0.22 0.00 0.00 54.13 52.20 1be3 s LEU 109 Cb -0.10 -0.70 -0.15 0.00 0.50 0.00 0.00 46.19 45.74 1be3 s LEU 109 CO 0.47 -0.37 2.30 -0.81 -1.32 0.00 0.00 176.35 176.62 1be3 n PRO 110 N 4.54 0.63 -1.71 0.98 -0.04 -1.26 -4.88 135.00 133.25 1be3 n PRO 110 Ca 0.02 0.14 -0.43 0.00 -0.04 0.00 0.00 63.50 63.18 1be3 n PRO 110 Cb 0.40 -2.18 -0.03 0.00 -0.04 0.00 0.00 33.50 31.64 1be3 n PRO 110 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1be3 n PRO 111 N 8.20 2.54 -1.68 0.54 -0.04 -1.26 -4.56 135.00 138.75 1be3 n PRO 111 Ca 0.49 0.91 -0.46 0.00 -0.04 0.00 0.00 63.50 64.40 1be3 n PRO 111 Cb 0.17 -2.71 -0.04 0.00 -0.04 0.00 0.00 33.50 30.88 1be3 n PRO 111 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1be3 n ASP 112 N 3.18 3.50 0.12 3.54 -0.08 -1.26 -4.40 116.55 121.14 1be3 n ASP 112 Ca 0.14 1.02 0.13 0.00 -1.51 0.00 0.00 54.79 54.56 1be3 n ASP 112 Cb 0.34 -1.44 0.34 0.00 2.34 0.00 0.00 41.12 42.69 1be3 n ASP 112 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 1be3 h LEU 113 N 7.82 0.00 -0.39 -2.67 3.38 -1.00 -3.37 115.31 119.08 1be3 h LEU 113 Ca -0.47 -0.03 0.04 0.00 0.09 0.00 0.00 57.88 57.52 1be3 h LEU 113 Cb 1.25 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.95 1be3 h LEU 113 CO 0.93 0.01 -0.22 -1.20 0.09 0.00 0.00 178.44 178.05 1be3 n SER 114 N -2.37 -0.39 -0.31 -0.43 7.64 -1.25 -1.58 113.62 114.93 1be3 n SER 114 Ca 0.05 0.69 0.05 0.00 1.01 0.00 0.00 58.87 60.67 1be3 n SER 114 Cb 0.45 -0.10 0.02 0.00 -1.01 0.00 0.00 64.21 63.57 1be3 n SER 114 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1be3 n TYR 115 N -4.50 0.00 -0.26 1.43 4.11 -1.26 -1.79 117.16 114.89 1be3 n TYR 115 Ca 0.01 0.00 0.07 0.00 -0.00 0.00 0.00 57.90 57.98 1be3 n TYR 115 Cb 0.11 0.00 0.14 0.00 -0.00 0.00 0.00 39.34 39.60 1be3 n TYR 115 CO 0.00 0.00 0.00 1.51 -0.00 0.00 0.00 176.86 178.37 1be3 n ILE 116 N 0.20 -0.31 -0.13 -3.48 3.06 -0.61 0.18 119.36 118.27 1be3 n ILE 116 Ca 0.05 1.64 -0.06 0.00 -2.50 0.00 0.00 62.75 61.88 1be3 n ILE 116 Cb 0.22 -2.32 0.12 0.00 0.54 0.00 0.00 39.64 38.20 1be3 n ILE 116 CO 0.00 0.00 0.00 0.58 -2.50 0.00 0.00 176.55 174.63 1be3 h VAL 117 N 0.00 1.25 0.00 9.51 2.07 -1.86 -2.53 116.25 124.68 1be3 h VAL 117 Ca 0.38 -1.08 -0.16 0.00 0.82 0.00 0.00 66.70 66.66 1be3 h VAL 117 Cb 0.67 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 1be3 h VAL 117 CO -0.72 0.38 -1.22 0.03 0.02 0.00 0.00 177.57 176.06 1be3 h ARG 118 N 0.78 0.00 0.00 1.57 3.08 0.15 -3.28 114.38 116.68 1be3 h ARG 118 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.19 1be3 h ARG 118 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.56 1be3 h ARG 118 CO 0.03 0.37 0.00 0.00 -1.07 0.00 0.00 179.97 179.30 1be3 n ALA 119 N -2.37 0.00 -1.11 0.04 0.00 0.43 -4.83 120.51 112.67 1be3 n ALA 119 Ca -0.07 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.01 1be3 n ALA 119 Cb 0.83 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 20.28 1be3 n ALA 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1be3 n ARG 120 N 0.00 0.00 -1.67 0.00 1.74 -1.10 -4.76 116.66 110.87 1be3 n ARG 120 Ca 0.00 0.00 -0.45 0.00 -0.77 0.00 0.00 57.85 56.63 1be3 n ARG 120 Cb 0.00 -0.85 -0.04 0.00 -1.02 0.00 0.00 32.46 30.55 1be3 n ARG 120 CO 0.00 0.00 0.00 1.58 -1.52 0.00 0.00 177.63 177.69 1be3 n HIS 121 N -0.79 2.39 0.00 -1.55 -0.00 -1.26 -3.52 115.22 110.49 1be3 n HIS 121 Ca 0.10 -0.18 0.00 0.00 -0.00 0.00 0.00 57.72 57.64 1be3 n HIS 121 Cb 0.33 -2.73 0.00 0.00 -0.00 0.00 0.00 29.99 27.59 1be3 n HIS 121 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1be3 n GLY 122 N 4.55 1.19 4.42 1.57 0.00 -1.26 -4.89 105.19 110.78 1be3 n GLY 122 Ca 0.22 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.27 1be3 n GLY 122 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1be3 n GLY 123 N -0.13 -0.45 0.03 -0.02 0.00 -1.23 -2.82 105.19 100.56 1be3 n GLY 123 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.66 1be3 n GLY 123 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1be3 n GLU 124 N -1.13 0.00 0.01 1.61 0.28 -1.26 0.23 120.64 120.38 1be3 n GLU 124 Ca 0.00 0.07 -0.10 0.00 -0.16 0.00 0.00 57.16 56.98 1be3 n GLU 124 Cb 0.09 -1.76 -0.08 0.00 1.43 0.00 0.00 31.44 31.13 1be3 n GLU 124 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 177.13 176.53 1be3 h ASP 125 N 0.00 -0.12 0.43 -1.84 3.32 -1.89 -2.74 116.42 113.59 1be3 h ASP 125 Ca 0.00 -0.44 -0.01 0.00 0.02 0.00 0.00 57.03 56.60 1be3 h ASP 125 Cb 0.93 0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.51 1be3 h ASP 125 CO 0.00 0.52 -0.29 0.22 -1.72 0.00 0.00 179.24 177.98 1be3 h TYR 126 N -0.90 -0.75 -0.80 4.55 5.03 -0.05 -0.22 116.97 123.83 1be3 h TYR 126 Ca -0.01 -0.01 0.17 0.00 2.58 0.00 0.00 58.73 61.46 1be3 h TYR 126 Cb 0.54 0.27 -0.11 0.00 1.55 0.00 0.00 36.73 38.99 1be3 h TYR 126 CO 0.11 -0.43 0.30 0.28 -1.32 0.00 0.00 178.16 177.10 1be3 h VAL 127 N -0.69 0.57 0.09 1.81 2.07 -1.69 0.18 116.25 118.59 1be3 h VAL 127 Ca -0.04 -0.14 -0.00 0.00 0.82 0.00 0.00 66.70 67.34 1be3 h VAL 127 Cb 0.58 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 1be3 h VAL 127 CO 0.03 0.07 -0.05 0.15 0.02 0.00 0.00 177.57 177.80 1be3 h PHE 128 N 0.39 -0.12 0.00 1.57 3.57 -1.14 -2.84 116.94 118.38 1be3 h PHE 128 Ca 0.46 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.96 1be3 h PHE 128 Cb 0.77 0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.55 1be3 h PHE 128 CO -0.18 0.01 0.00 0.77 -2.23 0.00 0.00 178.31 176.68 1be3 h SER 129 N -0.22 0.00 0.18 0.41 0.02 0.95 -0.39 113.55 114.51 1be3 h SER 129 Ca -0.01 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 1be3 h SER 129 Cb 0.18 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.72 1be3 h SER 129 CO 0.02 0.00 -0.09 0.25 -1.14 0.00 0.00 176.83 175.87 1be3 h LEU 130 N 0.00 -0.21 -0.81 5.07 5.85 -0.64 -2.24 115.31 122.33 1be3 h LEU 130 Ca 0.00 0.01 0.12 0.00 0.84 0.00 0.00 57.88 58.85 1be3 h LEU 130 Cb 0.18 0.05 -0.08 0.00 0.37 0.00 0.00 40.66 41.18 1be3 h LEU 130 CO 0.00 0.16 0.42 -0.07 -0.34 0.00 0.00 178.44 178.61 1be3 h LEU 131 N -0.86 0.54 -0.13 2.25 3.38 -1.36 0.05 115.31 119.18 1be3 h LEU 131 Ca -0.03 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1be3 h LEU 131 Cb 0.19 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1be3 h LEU 131 CO 0.04 0.26 -0.36 0.41 0.09 0.00 0.00 178.44 178.88 1be3 n THR 132 N -4.84 0.00 -3.54 0.22 -1.04 -0.17 -4.71 114.28 100.21 1be3 n THR 132 Ca 0.15 -0.03 -0.42 0.00 -2.04 0.00 0.00 64.05 61.71 1be3 n THR 132 Cb 0.37 0.18 -0.10 0.00 -1.82 0.00 0.00 70.33 68.96 1be3 n THR 132 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 1be3 s GLY 133 N -2.84 1.98 -0.28 3.41 0.00 0.00 -4.98 107.32 104.62 1be3 s GLY 133 Ca 0.16 -1.98 -0.03 0.00 0.00 0.00 0.00 44.72 42.87 1be3 s GLY 133 CO 0.62 0.95 0.53 -0.19 0.00 0.00 0.00 173.10 175.01 1be3 s TYR 134 N 1.54 -1.29 0.30 1.90 2.02 -1.26 -4.45 117.35 116.10 1be3 s TYR 134 Ca 0.03 1.50 0.04 0.00 -0.37 0.00 0.00 57.07 58.27 1be3 s TYR 134 Cb -0.22 0.41 -0.06 0.00 -0.40 0.00 0.00 41.96 41.69 1be3 s TYR 134 CO 0.05 -0.78 0.04 0.00 -1.57 0.00 0.00 175.55 173.29 1be3 s GLU 136 N -3.89 4.26 0.29 0.00 2.12 -1.26 -4.81 118.70 115.41 1be3 s GLU 136 Ca 0.35 1.95 -0.15 0.00 0.36 0.00 0.00 54.97 57.48 1be3 s GLU 136 Cb 0.08 -3.66 -0.11 0.00 0.26 0.00 0.00 34.13 30.70 1be3 s GLU 136 CO 0.14 -0.63 0.05 -2.30 -0.54 0.00 0.00 175.26 171.98 1be3 n PRO 137 N 5.82 0.00 -3.05 4.30 -0.02 -1.26 -4.83 135.00 135.95 1be3 n PRO 137 Ca 0.14 0.00 -0.40 0.00 -2.02 0.00 0.00 63.50 61.22 1be3 n PRO 137 Cb 0.44 -0.70 -0.05 0.00 -0.02 0.00 0.00 33.50 33.17 1be3 n PRO 137 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1be3 s PRO 138 N -0.70 4.43 -0.00 0.52 0.04 -1.26 -4.98 135.00 133.05 1be3 s PRO 138 Ca 0.41 0.86 -0.10 0.00 0.04 0.00 0.00 61.00 62.21 1be3 s PRO 138 Cb -0.44 -3.45 -0.05 0.00 0.04 0.00 0.00 34.50 30.59 1be3 s PRO 138 CO 0.44 0.05 0.27 2.41 0.04 0.00 0.00 177.00 180.22 1be3 n THR 139 N 3.81 0.00 -0.62 1.26 -1.04 -1.26 -0.81 114.28 115.62 1be3 n THR 139 Ca -0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.00 1be3 n THR 139 Cb 0.51 -0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.02 1be3 n THR 139 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1be3 n GLY 140 N 0.39 0.98 3.90 3.41 0.00 -1.26 -5.04 105.19 107.58 1be3 n GLY 140 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 1be3 n GLY 140 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1be3 s VAL 141 N -3.31 5.22 0.16 1.61 1.01 0.01 -5.11 120.40 119.99 1be3 s VAL 141 Ca 0.00 -0.10 0.09 0.00 0.00 0.00 0.00 61.98 61.98 1be3 s VAL 141 Cb 0.00 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.71 1be3 s VAL 141 CO 0.00 0.04 -0.14 -0.94 0.00 0.00 0.00 175.10 174.06 1be3 s SER 142 N -2.51 4.02 -0.09 3.32 1.04 -1.26 -4.92 113.70 113.31 1be3 s SER 142 Ca 0.39 -0.61 -0.04 0.00 0.48 0.00 0.00 55.95 56.18 1be3 s SER 142 Cb -0.12 -0.60 0.05 0.00 0.10 0.00 0.00 66.02 65.45 1be3 s SER 142 CO 0.26 0.13 0.18 -0.76 0.98 0.00 0.00 173.24 174.03 1be3 s LEU 143 N -2.59 -0.10 0.37 2.42 1.43 -1.26 -5.12 118.68 113.83 1be3 s LEU 143 Ca 0.22 0.39 -0.28 0.00 -1.03 0.00 0.00 54.13 53.43 1be3 s LEU 143 Cb -0.09 0.36 -0.10 0.00 0.03 0.00 0.00 46.19 46.39 1be3 s LEU 143 CO 0.13 -0.24 1.38 -0.13 0.23 0.00 0.00 176.35 177.72 1be3 s ARG 144 N 2.29 4.16 0.31 1.70 1.81 -1.26 -4.86 118.95 123.10 1be3 s ARG 144 Ca 0.02 2.35 0.06 0.00 -1.72 0.00 0.00 55.73 56.45 1be3 s ARG 144 Cb -0.12 -2.96 0.86 0.00 -0.45 0.00 0.00 34.95 32.28 1be3 s ARG 144 CO -0.06 -0.40 1.62 0.93 -0.68 0.00 0.00 175.30 176.71 1be3 h GLU 145 N 3.06 0.14 0.00 3.54 5.08 -2.02 0.69 114.58 125.08 1be3 h GLU 145 Ca -0.50 -0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 57.79 1be3 h GLU 145 Cb 1.24 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 1be3 h GLU 145 CO 0.64 0.09 -0.29 0.78 -1.00 0.00 0.00 179.01 179.24 1be3 h GLY 146 N 0.14 0.00 -4.23 -3.84 0.00 -1.93 -3.30 103.07 89.91 1be3 h GLY 146 Ca 0.63 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 47.66 1be3 h GLY 146 CO -0.73 0.00 0.30 1.04 0.00 0.00 0.00 176.54 177.15 1be3 n LEU 147 N -3.60 5.90 -4.34 3.11 4.77 0.24 -3.84 117.00 119.25 1be3 n LEU 147 Ca -0.01 -3.49 -0.41 0.00 -0.03 0.00 0.00 56.01 52.08 1be3 n LEU 147 Cb 0.42 -1.41 0.01 0.00 -2.33 0.00 0.00 43.42 40.10 1be3 n LEU 147 CO 0.35 1.76 -0.33 -1.22 -1.33 0.00 0.00 177.39 176.62 1be3 n TYR 148 N 2.39 -1.82 -3.59 -1.77 4.02 -1.04 -4.61 117.16 110.74 1be3 n TYR 148 Ca 0.49 0.55 -0.39 0.00 -0.01 0.00 0.00 57.90 58.54 1be3 n TYR 148 Cb 0.77 -1.82 -0.11 0.00 -0.02 0.00 0.00 39.34 38.16 1be3 n TYR 148 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 176.86 175.97 1be3 s PHE 149 N -1.73 3.21 -0.15 -0.72 2.19 -1.26 -1.99 117.98 117.52 1be3 s PHE 149 Ca 0.61 -0.10 0.01 0.00 0.33 0.00 0.00 56.93 57.78 1be3 s PHE 149 Cb -0.57 -2.40 0.00 0.00 -1.31 0.00 0.00 43.02 38.75 1be3 s PHE 149 CO 0.62 -0.27 -0.18 1.21 1.83 0.00 0.00 175.22 178.43 1be3 s ASN 150 N 1.72 3.45 0.26 6.13 3.84 -1.26 -4.09 114.94 124.99 1be3 s ASN 150 Ca 0.06 -0.52 0.17 0.00 0.21 0.00 0.00 52.86 52.79 1be3 s ASN 150 Cb -0.16 -1.52 0.93 0.00 -0.55 0.00 0.00 41.25 39.95 1be3 s ASN 150 CO 0.10 0.09 1.53 -2.65 -2.79 0.00 0.00 177.10 173.37 1be3 n PRO 151 N 4.02 0.11 -1.19 0.43 -0.02 -1.26 -2.59 135.00 134.50 1be3 n PRO 151 Ca -0.19 0.61 -0.02 0.00 -2.02 0.00 0.00 63.50 61.88 1be3 n PRO 151 Cb 0.52 -1.87 0.13 0.00 -0.02 0.00 0.00 33.50 32.26 1be3 n PRO 151 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1be3 n TYR 152 N -2.10 0.74 -4.22 6.00 4.01 -1.26 -4.20 117.16 116.13 1be3 n TYR 152 Ca -0.01 -1.58 -0.34 0.00 -0.16 0.00 0.00 57.90 55.81 1be3 n TYR 152 Cb 0.03 -0.26 -0.10 0.00 -0.31 0.00 0.00 39.34 38.70 1be3 n TYR 152 CO 0.00 0.00 0.00 0.12 -0.46 0.00 0.00 176.86 176.52 1be3 s PHE 153 N -2.93 3.16 0.03 -0.72 2.19 -1.07 -4.89 117.98 113.75 1be3 s PHE 153 Ca 0.40 -0.02 -0.05 0.00 0.33 0.00 0.00 56.93 57.59 1be3 s PHE 153 Cb 0.38 -1.97 -0.01 0.00 -1.31 0.00 0.00 43.02 40.10 1be3 s PHE 153 CO -0.06 0.17 0.52 -2.30 1.83 0.00 0.00 175.22 175.39 1be3 n PRO 154 N 3.20 -0.07 0.00 10.12 -0.02 -1.26 0.21 135.00 147.18 1be3 n PRO 154 Ca -0.17 0.52 0.04 0.00 -2.02 0.00 0.00 63.50 61.86 1be3 n PRO 154 Cb 0.53 -0.77 0.21 0.00 -0.02 0.00 0.00 33.50 33.44 1be3 n PRO 154 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1be3 n GLY 155 N -1.04 -0.99 2.48 -1.23 0.00 -1.26 -4.67 105.19 98.47 1be3 n GLY 155 Ca 0.00 -0.04 -0.17 0.00 0.00 0.00 0.00 46.02 45.81 1be3 n GLY 155 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1be3 n GLN 156 N -0.61 -2.29 -3.54 1.61 6.02 0.56 -4.99 117.38 114.15 1be3 n GLN 156 Ca 0.05 0.77 -0.17 0.00 -0.01 0.00 0.00 57.00 57.64 1be3 n GLN 156 Cb 0.02 -5.20 -0.06 0.00 1.02 0.00 0.00 30.24 26.03 1be3 n GLN 156 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1be3 s ALA 157 N -2.90 -1.79 -0.00 -1.58 0.00 -1.26 -4.36 121.76 109.86 1be3 s ALA 157 Ca 0.09 1.42 -0.09 0.00 0.00 0.00 0.00 51.96 53.37 1be3 s ALA 157 Cb -0.04 -0.19 0.01 0.00 0.00 0.00 0.00 23.12 22.90 1be3 s ALA 157 CO 0.11 -0.36 0.19 -1.50 0.00 0.00 0.00 175.76 174.20 1be3 s ILE 158 N -1.02 0.08 -0.81 0.00 2.07 -0.84 -4.85 121.20 115.82 1be3 s ILE 158 Ca -0.09 -0.63 -0.04 0.00 -1.41 0.00 0.00 60.65 58.48 1be3 s ILE 158 Cb -0.01 -0.48 0.12 0.00 0.13 0.00 0.00 42.46 42.22 1be3 s ILE 158 CO 0.08 -0.34 2.53 0.61 -1.91 0.00 0.00 174.94 175.91 1be3 n GLY 159 N 1.41 4.83 3.13 1.50 0.00 -1.25 -2.48 105.19 112.33 1be3 n GLY 159 Ca -0.22 -2.03 -0.35 0.00 0.00 0.00 0.00 46.02 43.42 1be3 n GLY 159 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1be3 s MET 160 N -1.86 2.16 0.98 1.61 0.00 -1.26 -5.02 119.30 115.91 1be3 s MET 160 Ca 0.56 -1.53 -0.20 0.00 0.00 0.00 0.00 55.69 54.51 1be3 s MET 160 Cb 0.31 -3.31 -0.03 0.00 0.00 0.00 0.00 34.83 31.79 1be3 s MET 160 CO -0.19 -0.81 -0.65 0.00 0.00 0.00 0.00 175.02 173.37 1be3 n ALA 161 N 4.56 -3.40 -1.53 4.11 0.00 -1.26 -4.48 120.51 118.51 1be3 n ALA 161 Ca -0.07 -1.16 -0.28 0.00 0.00 0.00 0.00 53.44 51.92 1be3 n ALA 161 Cb 0.42 -0.93 -0.12 0.00 0.00 0.00 0.00 19.45 18.82 1be3 n ALA 161 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1be3 n PRO 162 N 0.43 0.37 0.04 0.00 -0.04 -1.26 -4.76 135.00 129.78 1be3 n PRO 162 Ca 0.00 -0.20 -0.15 0.00 -0.04 0.00 0.00 63.50 63.12 1be3 n PRO 162 Cb 0.58 -2.34 -0.09 0.00 -0.04 0.00 0.00 33.50 31.61 1be3 n PRO 162 CO 0.00 0.00 0.00 -1.35 -0.04 0.00 0.00 175.50 174.11 1be3 h PRO 163 N 13.71 -0.59 -2.89 0.54 0.11 -1.90 -3.43 132.00 137.56 1be3 h PRO 163 Ca -0.06 0.04 -0.18 0.00 0.11 0.00 0.00 66.00 65.91 1be3 h PRO 163 Cb 1.18 0.13 -0.30 0.00 0.11 0.00 0.00 31.00 32.13 1be3 h PRO 163 CO 1.31 -0.39 -0.45 0.42 -0.21 0.00 0.00 178.00 178.67 1be3 s ILE 164 N -5.52 -0.15 0.22 4.15 1.01 -1.26 -4.98 121.20 114.67 1be3 s ILE 164 Ca -0.15 0.17 0.05 0.00 0.00 0.00 0.00 60.65 60.72 1be3 s ILE 164 Cb 0.06 -0.45 -0.05 0.00 0.01 0.00 0.00 42.46 42.03 1be3 s ILE 164 CO 0.56 0.07 -0.04 -0.72 0.00 0.00 0.00 174.94 174.81 1be3 s TYR 165 N 1.62 1.58 0.49 3.97 -0.85 -1.26 -4.91 117.35 117.98 1be3 s TYR 165 Ca -0.07 -0.82 -0.24 0.00 -0.52 0.00 0.00 57.07 55.42 1be3 s TYR 165 Cb -0.10 -0.88 -0.07 0.00 0.38 0.00 0.00 41.96 41.29 1be3 s TYR 165 CO -0.10 0.07 1.41 -0.80 -1.52 0.00 0.00 175.55 174.61 1be3 s ASN 166 N -3.30 5.63 -1.38 -0.18 0.01 -1.26 -2.59 114.94 111.86 1be3 s ASN 166 Ca 0.26 2.88 -0.01 0.00 -0.71 0.00 0.00 52.86 55.27 1be3 s ASN 166 Cb 0.04 -2.65 0.01 0.00 0.41 0.00 0.00 41.25 39.06 1be3 s ASN 166 CO 0.07 -1.34 0.56 1.21 -1.51 0.00 0.00 177.10 176.09 1be3 n GLU 167 N -0.52 -4.01 0.09 -0.60 2.13 -1.03 -4.88 120.64 111.82 1be3 n GLU 167 Ca 0.07 0.50 -0.23 0.00 0.66 0.00 0.00 57.16 58.15 1be3 n GLU 167 Cb 0.43 -4.84 -0.15 0.00 0.27 0.00 0.00 31.44 27.15 1be3 n GLU 167 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1be3 h VAL 168 N -1.85 1.14 -3.37 6.31 2.07 -1.79 -3.48 116.25 115.28 1be3 h VAL 168 Ca -0.62 -2.57 -0.17 0.00 0.82 0.00 0.00 66.70 64.16 1be3 h VAL 168 Cb 1.37 2.92 -0.04 0.00 -1.52 0.00 0.00 31.29 34.02 1be3 h VAL 168 CO 0.61 0.81 -0.14 0.18 0.02 0.00 0.00 177.57 179.04 1be3 n LEU 169 N -3.74 0.00 -3.84 2.57 4.77 -1.26 -5.01 117.00 110.49 1be3 n LEU 169 Ca -0.21 -0.97 -0.15 0.00 -0.03 0.00 0.00 56.01 54.65 1be3 n LEU 169 Cb 1.04 0.37 -0.15 0.00 -2.33 0.00 0.00 43.42 42.35 1be3 n LEU 169 CO 0.53 -0.15 -0.37 -0.70 -1.33 0.00 0.00 177.39 175.37 1be3 s GLU 170 N -2.47 0.16 0.30 3.23 2.12 -1.26 -4.85 118.70 115.93 1be3 s GLU 170 Ca 0.08 0.05 -0.09 0.00 0.36 0.00 0.00 54.97 55.38 1be3 s GLU 170 Cb 0.00 -0.30 -0.06 0.00 0.26 0.00 0.00 34.13 34.03 1be3 s GLU 170 CO 0.06 -0.08 0.62 -0.06 -0.54 0.00 0.00 175.26 175.26 1be3 s PHE 171 N 0.64 3.45 0.12 5.30 0.08 -1.26 -5.00 117.98 121.31 1be3 s PHE 171 Ca -0.06 0.86 -0.31 0.00 0.12 0.00 0.00 56.93 57.54 1be3 s PHE 171 Cb -0.09 -2.27 -0.11 0.00 -0.57 0.00 0.00 43.02 39.99 1be3 s PHE 171 CO -0.01 0.13 1.52 0.22 -0.10 0.00 0.00 175.22 176.97 1be3 h ASP 172 N 1.89 -1.73 -0.08 1.36 1.82 -2.01 -3.07 116.42 114.60 1be3 h ASP 172 Ca -0.47 0.22 -0.00 0.00 -0.39 0.00 0.00 57.03 56.39 1be3 h ASP 172 Cb 1.18 0.70 -0.00 0.00 0.68 0.00 0.00 39.33 41.89 1be3 h ASP 172 CO 0.66 -0.39 0.05 -0.78 -1.61 0.00 0.00 179.24 177.17 1be3 h ASP 173 N -0.41 0.10 0.00 2.28 1.82 -2.05 -3.46 116.42 114.70 1be3 h ASP 173 Ca 0.06 -0.08 0.00 0.00 -0.39 0.00 0.00 57.03 56.62 1be3 h ASP 173 Cb 0.58 -0.03 0.00 0.00 0.68 0.00 0.00 39.33 40.56 1be3 h ASP 173 CO -0.53 0.15 0.00 0.61 -1.61 0.00 0.00 179.24 177.86 1be3 n GLY 174 N -0.91 -0.72 3.14 -0.78 0.00 -1.16 -5.09 105.19 99.67 1be3 n GLY 174 Ca -0.06 0.00 -0.57 0.00 0.00 0.00 0.00 46.02 45.39 1be3 n GLY 174 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1be3 n THR 175 N 0.00 0.00 -1.30 2.61 -1.04 -1.26 -4.68 114.28 108.61 1be3 n THR 175 Ca 0.00 0.00 -0.57 0.00 -2.04 0.00 0.00 64.05 61.44 1be3 n THR 175 Cb 0.00 -0.45 -0.12 0.00 -1.82 0.00 0.00 70.33 67.94 1be3 n THR 175 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1be3 n PRO 176 N 5.32 0.07 -2.56 -2.82 -0.02 -1.26 -4.63 135.00 129.11 1be3 n PRO 176 Ca 0.40 0.02 -0.42 0.00 -2.02 0.00 0.00 63.50 61.48 1be3 n PRO 176 Cb -0.04 -1.57 -0.01 0.00 -0.02 0.00 0.00 33.50 31.86 1be3 n PRO 176 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1be3 s ALA 177 N 6.54 3.10 -0.09 3.55 0.00 -1.26 -4.67 121.76 128.92 1be3 s ALA 177 Ca 1.22 -2.71 -0.06 0.00 0.00 0.00 0.00 51.96 50.40 1be3 s ALA 177 Cb -1.42 -4.62 -0.04 0.00 0.00 0.00 0.00 23.12 17.04 1be3 s ALA 177 CO 0.62 -3.45 0.16 0.99 0.00 0.00 0.00 175.76 174.08 1be3 s THR 178 N 4.67 5.48 0.19 0.00 2.01 -1.26 -2.45 115.64 124.27 1be3 s THR 178 Ca 0.52 0.14 -0.07 0.00 0.31 0.00 0.00 61.69 62.59 1be3 s THR 178 Cb 0.03 -3.44 0.28 0.00 0.01 0.00 0.00 72.50 69.37 1be3 s THR 178 CO 0.03 0.55 1.08 0.80 -0.69 0.00 0.00 174.62 176.39 1be3 n MET 179 N 1.72 -0.09 -0.00 4.92 1.56 -1.26 0.47 117.12 124.43 1be3 n MET 179 Ca -0.18 1.08 -0.17 0.00 -0.27 0.00 0.00 57.70 58.16 1be3 n MET 179 Cb 0.54 -1.61 -0.11 0.00 2.15 0.00 0.00 33.22 34.20 1be3 n MET 179 CO 0.00 0.00 0.00 0.66 -0.73 0.00 0.00 175.97 175.90 1be3 h SER 180 N 0.00 0.49 -0.80 6.12 4.64 -1.94 -1.86 113.55 120.21 1be3 h SER 180 Ca 0.31 -0.75 0.10 0.00 -0.47 0.00 0.00 61.79 60.98 1be3 h SER 180 Cb 0.48 -0.15 -0.06 0.00 -0.31 0.00 0.00 62.40 62.37 1be3 h SER 180 CO -0.71 1.17 0.52 1.56 -0.87 0.00 0.00 176.83 178.51 1be3 h GLN 181 N -0.14 0.68 -0.09 4.77 4.20 -0.29 0.52 115.11 124.76 1be3 h GLN 181 Ca -0.06 -0.04 -0.06 0.00 0.06 0.00 0.00 58.65 58.54 1be3 h GLN 181 Cb 1.24 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.87 1be3 h GLN 181 CO 0.11 0.45 -0.18 0.28 -0.67 0.00 0.00 178.83 178.81 1be3 h VAL 182 N 0.70 1.40 0.28 -0.54 2.07 -0.06 -2.94 116.25 117.16 1be3 h VAL 182 Ca 0.37 -1.48 0.00 0.00 0.82 0.00 0.00 66.70 66.42 1be3 h VAL 182 Cb 0.49 2.14 -0.03 0.00 -1.52 0.00 0.00 31.29 32.37 1be3 h VAL 182 CO -0.14 0.42 -0.39 0.00 0.02 0.00 0.00 177.57 177.48 1be3 h ALA 183 N 0.51 -0.78 -0.93 1.67 0.00 -0.20 0.37 119.26 119.90 1be3 h ALA 183 Ca 0.00 -0.11 0.27 0.00 0.00 0.00 0.00 54.91 55.08 1be3 h ALA 183 Cb 0.77 0.59 -0.16 0.00 0.00 0.00 0.00 17.79 18.99 1be3 h ALA 183 CO 0.04 -0.98 0.23 -0.22 0.00 0.00 0.00 179.25 178.32 1be3 h LYS 184 N -0.72 0.13 0.00 0.00 3.64 -0.14 0.90 116.57 120.37 1be3 h LYS 184 Ca -0.01 -0.01 -0.14 0.00 -1.27 0.00 0.00 60.65 59.22 1be3 h LYS 184 Cb 0.68 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.46 1be3 h LYS 184 CO -0.13 0.08 -0.66 -0.44 -2.27 0.00 0.00 179.45 176.03 1be3 h ASP 185 N 0.13 0.00 -0.03 4.20 3.32 -0.76 -3.09 116.42 120.19 1be3 h ASP 185 Ca 0.61 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.64 1be3 h ASP 185 Cb 1.31 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.86 1be3 h ASP 185 CO -0.74 0.66 -0.04 0.58 -1.72 0.00 0.00 179.24 177.99 1be3 h VAL 186 N 0.00 1.41 -0.02 -1.35 2.07 0.46 -2.60 116.25 116.23 1be3 h VAL 186 Ca -0.01 -1.29 0.01 0.00 0.82 0.00 0.00 66.70 66.23 1be3 h VAL 186 Cb 1.19 2.22 -0.02 0.00 -1.52 0.00 0.00 31.29 33.16 1be3 h VAL 186 CO 0.09 0.34 -0.15 0.00 0.02 0.00 0.00 177.57 177.87 1be3 n THR 188 N -3.36 -0.23 -0.13 0.00 -1.04 -1.17 0.33 114.28 108.68 1be3 n THR 188 Ca -0.02 1.47 0.28 0.00 -2.04 0.00 0.00 64.05 63.74 1be3 n THR 188 Cb 0.11 -1.88 0.70 0.00 -1.82 0.00 0.00 70.33 67.44 1be3 n THR 188 CO 0.00 0.00 0.00 0.15 -0.64 0.00 0.00 175.07 174.58 1be3 h PHE 189 N 0.00 0.00 0.05 -1.42 3.04 -1.40 0.60 116.94 117.81 1be3 h PHE 189 Ca 0.05 0.00 -0.00 0.00 3.98 0.00 0.00 57.97 62.00 1be3 h PHE 189 Cb 0.14 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.65 1be3 h PHE 189 CO -0.76 0.00 -0.02 -0.07 -2.02 0.00 0.00 178.31 175.44 1be3 h LEU 190 N 0.00 -0.05 -0.73 0.59 3.38 0.59 -2.82 115.31 116.28 1be3 h LEU 190 Ca 0.39 -0.52 0.15 0.00 0.09 0.00 0.00 57.88 58.00 1be3 h LEU 190 Cb 1.86 0.01 -0.14 0.00 0.09 0.00 0.00 40.66 42.49 1be3 h LEU 190 CO -0.00 0.51 -0.14 -0.09 0.09 0.00 0.00 178.44 178.81 1be3 h ARG 191 N -0.64 0.02 -0.50 1.13 9.65 0.24 -0.18 114.38 124.10 1be3 h ARG 191 Ca -0.01 -0.00 -0.08 0.00 -1.10 0.00 0.00 59.98 58.80 1be3 h ARG 191 Cb 0.57 -0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.12 1be3 h ARG 191 CO 0.01 0.01 0.00 2.35 2.80 0.00 0.00 179.97 185.14 1be3 h TRP 192 N 0.02 0.88 -0.39 2.20 7.01 -1.56 0.42 115.95 124.53 1be3 h TRP 192 Ca 0.36 -0.13 -0.11 0.00 2.11 0.00 0.00 58.89 61.12 1be3 h TRP 192 Cb 0.57 -0.24 -0.01 0.00 -2.10 0.00 0.00 29.16 27.38 1be3 h TRP 192 CO -0.54 0.81 -0.21 0.00 -2.79 0.00 0.00 178.44 175.70 1be3 h ALA 193 N 1.23 0.89 0.18 2.65 0.00 -0.83 0.14 119.26 123.52 1be3 h ALA 193 Ca 0.15 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 1be3 h ALA 193 Cb 0.46 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1be3 h ALA 193 CO 0.02 0.63 -0.08 0.00 0.00 0.00 0.00 179.25 179.81 1be3 h ALA 194 N 1.08 -0.24 -3.00 0.00 0.00 -0.32 -3.40 119.26 113.40 1be3 h ALA 194 Ca 0.10 -0.19 -0.62 0.00 0.00 0.00 0.00 54.91 54.20 1be3 h ALA 194 Cb 0.72 0.09 -0.41 0.00 0.00 0.00 0.00 17.79 18.19 1be3 h ALA 194 CO 0.06 -0.45 -0.69 -1.83 0.00 0.00 0.00 179.25 176.33 1be3 s GLU 195 N -4.63 1.81 0.29 0.00 -1.05 0.13 -4.92 118.70 110.32 1be3 s GLU 195 Ca -0.15 -2.66 -0.02 0.00 -0.15 0.00 0.00 54.97 51.99 1be3 s GLU 195 Cb 0.02 -2.79 0.62 0.00 -0.44 0.00 0.00 34.13 31.54 1be3 s GLU 195 CO 0.59 -1.24 1.53 -2.30 0.95 0.00 0.00 175.26 174.79 1be3 n PRO 196 N 2.74 -0.08 0.00 -4.83 -0.02 0.49 -0.49 135.00 132.80 1be3 n PRO 196 Ca 0.16 1.49 0.07 0.00 -2.02 0.00 0.00 63.50 63.20 1be3 n PRO 196 Cb 0.36 -2.30 0.44 0.00 -0.02 0.00 0.00 33.50 31.98 1be3 n PRO 196 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1be3 n GLU 197 N -5.52 0.61 -0.24 -0.52 0.00 -1.26 -4.13 120.64 109.59 1be3 n GLU 197 Ca 0.20 0.00 0.01 0.00 0.00 0.00 0.00 57.16 57.36 1be3 n GLU 197 Cb 0.64 -1.38 0.08 0.00 0.00 0.00 0.00 31.44 30.78 1be3 n GLU 197 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.13 178.38 1be3 h HIS 198 N 0.00 -0.36 0.00 -1.84 2.76 -1.16 -1.57 115.15 112.97 1be3 h HIS 198 Ca 0.00 0.06 -0.00 0.00 -2.20 0.00 0.00 60.37 58.23 1be3 h HIS 198 Cb 0.00 0.27 0.00 0.00 1.55 0.00 0.00 27.41 29.23 1be3 h HIS 198 CO 0.00 -0.30 -0.00 -0.44 -1.30 0.00 0.00 177.93 175.89 1be3 h ASP 199 N 0.00 -0.00 -0.25 3.26 3.32 -1.84 -3.06 116.42 117.85 1be3 h ASP 199 Ca 0.34 -0.72 0.04 0.00 0.02 0.00 0.00 57.03 56.70 1be3 h ASP 199 Cb 0.51 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.00 1be3 h ASP 199 CO -0.72 0.72 -0.49 -0.74 -1.72 0.00 0.00 179.24 176.29 1be3 h HIS 200 N -0.72 -1.49 -0.78 4.55 2.76 -1.83 -0.77 115.15 116.86 1be3 h HIS 200 Ca -0.00 0.06 0.13 0.00 -2.20 0.00 0.00 60.37 58.37 1be3 h HIS 200 Cb 0.72 0.68 -0.13 0.00 1.55 0.00 0.00 27.41 30.23 1be3 h HIS 200 CO 0.18 -0.46 -0.27 -2.13 -1.30 0.00 0.00 177.93 173.94 1be3 n ARG 201 N -5.10 -0.15 0.09 5.26 0.63 -0.60 0.47 116.66 117.26 1be3 n ARG 201 Ca -0.04 1.21 -0.06 0.00 -0.92 0.00 0.00 57.85 58.04 1be3 n ARG 201 Cb 0.32 -1.80 0.09 0.00 0.45 0.00 0.00 32.46 31.52 1be3 n ARG 201 CO 0.00 0.00 0.00 0.87 -2.51 0.00 0.00 177.63 175.99 1be3 h LYS 202 N 0.00 0.21 0.02 -0.14 1.57 -1.25 -0.15 116.57 116.83 1be3 h LYS 202 Ca 0.30 -0.16 -0.00 0.00 -1.87 0.00 0.00 60.65 58.92 1be3 h LYS 202 Cb 0.50 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.84 1be3 h LYS 202 CO -0.79 0.81 -0.01 -0.09 -0.57 0.00 0.00 179.45 178.80 1be3 h ARG 203 N 0.15 -0.03 -0.66 3.15 2.43 0.15 -2.19 114.38 117.37 1be3 h ARG 203 Ca -0.02 0.00 0.14 0.00 -0.81 0.00 0.00 59.98 59.30 1be3 h ARG 203 Cb 1.21 0.01 -0.11 0.00 -0.42 0.00 0.00 29.97 30.65 1be3 h ARG 203 CO 0.10 0.18 -0.00 0.52 -1.51 0.00 0.00 179.97 179.26 1be3 h MET 204 N -0.24 0.11 -0.99 0.20 2.86 -0.49 1.05 114.93 117.43 1be3 h MET 204 Ca -0.00 -0.01 0.22 0.00 -2.06 0.00 0.00 59.70 57.85 1be3 h MET 204 Cb 0.23 -0.02 -0.09 0.00 0.06 0.00 0.00 31.60 31.77 1be3 h MET 204 CO 0.01 0.07 0.63 0.78 1.06 0.00 0.00 176.91 179.45 1be3 h GLY 205 N 0.11 1.39 0.88 8.32 0.00 -0.77 0.31 103.07 113.32 1be3 h GLY 205 Ca 0.35 -0.27 -0.03 0.00 0.00 0.00 0.00 47.33 47.39 1be3 h GLY 205 CO -0.58 -0.08 -0.28 -2.00 0.00 0.00 0.00 176.54 173.59 1be3 h LEU 206 N 0.55 -0.67 -1.59 3.11 6.46 0.18 -1.39 115.31 121.95 1be3 h LEU 206 Ca 0.56 -0.02 0.04 0.00 -0.12 0.00 0.00 57.88 58.34 1be3 h LEU 206 Cb 1.18 0.17 -0.03 0.00 -0.73 0.00 0.00 40.66 41.26 1be3 h LEU 206 CO -0.31 -0.40 0.33 0.11 -0.62 0.00 0.00 178.44 177.55 1be3 h LYS 207 N -0.92 0.51 0.00 1.25 1.57 -0.71 -0.96 116.57 117.31 1be3 h LYS 207 Ca -0.08 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.65 1be3 h LYS 207 Cb 0.65 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.84 1be3 h LYS 207 CO 0.13 0.34 -0.10 1.98 -0.57 0.00 0.00 179.45 181.23 1be3 h MET 208 N 0.53 0.00 0.14 3.15 4.05 -0.35 -2.07 114.93 120.38 1be3 h MET 208 Ca 0.21 0.00 -0.27 0.00 -0.28 0.00 0.00 59.70 59.36 1be3 h MET 208 Cb 0.16 0.00 0.01 0.00 -0.80 0.00 0.00 31.60 30.97 1be3 h MET 208 CO -0.05 0.10 -1.31 -0.07 0.23 0.00 0.00 176.91 175.81 1be3 h LEU 209 N 0.00 0.48 0.50 3.39 3.38 -0.06 -2.95 115.31 120.06 1be3 h LEU 209 Ca -0.00 -0.90 -0.02 0.00 0.09 0.00 0.00 57.88 57.05 1be3 h LEU 209 Cb 0.76 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.35 1be3 h LEU 209 CO 0.01 1.59 -0.24 -0.07 0.09 0.00 0.00 178.44 179.82 1be3 h LEU 210 N -0.23 -0.57 -0.59 1.67 3.38 -1.30 -0.81 115.31 116.86 1be3 h LEU 210 Ca -0.26 -0.07 0.07 0.00 0.09 0.00 0.00 57.88 57.71 1be3 h LEU 210 Cb 1.81 0.15 -0.10 0.00 0.09 0.00 0.00 40.66 42.61 1be3 h LEU 210 CO 0.12 -0.23 -0.53 -0.03 0.09 0.00 0.00 178.44 177.85 1be3 h MET 211 N -0.94 -0.25 -0.01 1.13 4.05 -1.54 0.41 114.93 117.78 1be3 h MET 211 Ca -0.07 0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.37 1be3 h MET 211 Cb 0.60 0.06 -0.00 0.00 -0.80 0.00 0.00 31.60 31.46 1be3 h MET 211 CO 0.11 -0.17 0.04 1.98 0.23 0.00 0.00 176.91 179.10 1be3 h MET 212 N -0.26 0.00 -0.00 0.39 1.85 -1.47 0.45 114.93 115.89 1be3 h MET 212 Ca 0.12 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.21 1be3 h MET 212 Cb 0.55 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.58 1be3 h MET 212 CO -0.70 0.00 -0.08 0.41 -0.40 0.00 0.00 176.91 176.13 1be3 n GLY 213 N -1.17 -1.21 0.08 1.39 0.00 0.14 -1.42 105.19 103.01 1be3 n GLY 213 Ca -0.03 -0.20 -0.09 0.00 0.00 0.00 0.00 46.02 45.71 1be3 n GLY 213 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1be3 n LEU 214 N -1.24 0.53 0.03 0.99 4.77 0.15 -4.52 117.00 117.72 1be3 n LEU 214 Ca 0.12 -0.02 -0.15 0.00 -0.03 0.00 0.00 56.01 55.93 1be3 n LEU 214 Cb 0.28 0.20 -0.14 0.00 -2.33 0.00 0.00 43.42 41.43 1be3 n LEU 214 CO 0.25 0.47 -0.43 -0.07 -1.33 0.00 0.00 177.39 176.29 1be3 h LEU 215 N 0.00 0.26 -0.19 2.23 3.38 -1.35 -2.94 115.31 116.69 1be3 h LEU 215 Ca -0.43 -0.42 -0.02 0.00 0.09 0.00 0.00 57.88 57.09 1be3 h LEU 215 Cb 1.93 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 42.59 1be3 h LEU 215 CO 0.01 1.36 0.04 -0.07 0.09 0.00 0.00 178.44 179.87 1be3 h LEU 216 N 0.05 0.30 -0.35 1.67 3.38 -1.50 -0.71 115.31 118.15 1be3 h LEU 216 Ca -0.27 -0.24 -0.14 0.00 0.09 0.00 0.00 57.88 57.32 1be3 h LEU 216 Cb 2.00 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 42.67 1be3 h LEU 216 CO 0.12 0.46 -0.34 -0.65 0.09 0.00 0.00 178.44 178.13 1be3 h PRO 217 N 0.12 0.84 0.55 1.13 0.11 -1.79 -1.59 132.00 131.36 1be3 h PRO 217 Ca 0.06 -0.44 -0.03 0.00 0.11 0.00 0.00 66.00 65.70 1be3 h PRO 217 Cb 0.29 0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.41 1be3 h PRO 217 CO 0.00 1.08 -0.30 -0.07 -0.21 0.00 0.00 178.00 178.50 1be3 h LEU 218 N 0.63 -0.74 -2.01 2.35 3.38 -1.40 -2.57 115.31 114.95 1be3 h LEU 218 Ca 0.06 0.03 0.11 0.00 0.09 0.00 0.00 57.88 58.17 1be3 h LEU 218 Cb 0.92 0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.86 1be3 h LEU 218 CO 0.08 -0.48 0.41 0.58 0.09 0.00 0.00 178.44 179.12 1be3 h VAL 219 N -0.79 0.40 -0.48 1.22 2.07 -1.18 0.76 116.25 118.25 1be3 h VAL 219 Ca -0.08 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.33 1be3 h VAL 219 Cb 0.62 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 1be3 h VAL 219 CO 0.10 0.00 -0.17 0.22 0.02 0.00 0.00 177.57 177.74 1be3 h TYR 220 N 0.00 1.06 0.75 1.57 3.20 -1.02 -2.24 116.97 120.28 1be3 h TYR 220 Ca 0.18 -0.23 -0.03 0.00 3.14 0.00 0.00 58.73 61.79 1be3 h TYR 220 Cb 0.99 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 39.00 1be3 h TYR 220 CO 0.00 1.02 -0.48 0.00 -1.64 0.00 0.00 178.16 177.06 1be3 h ALA 221 N 0.98 -1.26 -0.96 1.82 0.00 0.91 -1.59 119.26 119.16 1be3 h ALA 221 Ca 0.12 -0.24 0.22 0.00 0.00 0.00 0.00 54.91 55.00 1be3 h ALA 221 Cb 0.72 0.61 -0.18 0.00 0.00 0.00 0.00 17.79 18.94 1be3 h ALA 221 CO 0.06 -1.22 -0.16 -1.33 0.00 0.00 0.00 179.25 176.60 1be3 n MET 222 N -5.50 -0.08 0.04 0.00 2.81 -0.88 0.86 117.12 114.37 1be3 n MET 222 Ca -0.14 1.49 0.03 0.00 -1.81 0.00 0.00 57.70 57.26 1be3 n MET 222 Cb 0.49 -2.26 0.41 0.00 -0.71 0.00 0.00 33.22 31.14 1be3 n MET 222 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 1be3 h LYS 223 N 0.00 0.44 0.00 0.03 3.64 -0.69 -1.70 116.57 118.29 1be3 h LYS 223 Ca 0.50 -0.05 -0.19 0.00 -1.27 0.00 0.00 60.65 59.64 1be3 h LYS 223 Cb 0.86 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.56 1be3 h LYS 223 CO -0.97 0.38 -1.15 0.00 -2.27 0.00 0.00 179.45 175.44 1be3 h ARG 224 N 0.44 0.00 0.24 1.90 2.47 0.54 -2.57 114.38 117.39 1be3 h ARG 224 Ca 0.11 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.82 1be3 h ARG 224 Cb 0.11 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.42 1be3 h ARG 224 CO -0.01 0.58 -0.27 1.25 0.56 0.00 0.00 179.97 182.08 1be3 h HIS 225 N 0.00 -0.76 0.80 3.04 2.76 0.14 -0.16 115.15 120.97 1be3 h HIS 225 Ca -0.11 0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.03 1be3 h HIS 225 Cb 1.68 0.30 -0.00 0.00 1.55 0.00 0.00 27.41 30.94 1be3 h HIS 225 CO 0.00 -0.35 -0.46 0.87 -1.30 0.00 0.00 177.93 176.69 1be3 h LYS 226 N -0.52 -1.13 -0.94 5.26 1.79 -1.54 -3.04 116.57 116.45 1be3 h LYS 226 Ca -0.03 0.08 0.24 0.00 -2.18 0.00 0.00 60.65 58.76 1be3 h LYS 226 Cb 0.46 0.26 -0.06 0.00 -1.58 0.00 0.00 32.23 31.30 1be3 h LYS 226 CO -0.05 -0.75 0.64 -1.49 -1.08 0.00 0.00 179.45 176.72 1be3 h TRP 227 N -1.17 0.32 -0.82 -1.35 4.06 -1.47 -2.76 115.95 112.76 1be3 h TRP 227 Ca -0.11 0.01 0.23 0.00 2.06 0.00 0.00 58.89 61.08 1be3 h TRP 227 Cb 0.93 -0.10 -0.15 0.00 -1.00 0.00 0.00 29.16 28.84 1be3 h TRP 227 CO -0.06 0.07 0.03 -1.13 -3.56 0.00 0.00 178.44 173.78 1be3 n SER 228 N -4.42 -0.09 -0.16 -3.49 3.41 -0.07 0.55 113.62 109.35 1be3 n SER 228 Ca 0.20 1.39 -0.07 0.00 -0.26 0.00 0.00 58.87 60.13 1be3 n SER 228 Cb 0.86 -0.51 -0.01 0.00 -0.26 0.00 0.00 64.21 64.29 1be3 n SER 228 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1be3 h VAL 229 N 0.00 0.18 0.11 -3.33 2.07 -1.69 0.31 116.25 113.89 1be3 h VAL 229 Ca 0.50 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 68.02 1be3 h VAL 229 Cb 1.04 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 1be3 h VAL 229 CO -0.77 0.00 -0.05 -0.07 0.02 0.00 0.00 177.57 176.70 1be3 h LEU 230 N -0.23 -0.12 -1.32 2.57 3.38 -0.12 -2.96 115.31 116.51 1be3 h LEU 230 Ca 0.19 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 1be3 h LEU 230 Cb 0.55 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 1be3 h LEU 230 CO -0.61 0.29 0.08 0.11 0.09 0.00 0.00 178.44 178.40 1be3 h LYS 231 N -0.56 0.54 0.00 1.13 1.79 -0.87 -2.20 116.57 116.40 1be3 h LYS 231 Ca -0.01 -0.09 -0.01 0.00 -2.18 0.00 0.00 60.65 58.35 1be3 h LYS 231 Cb 0.45 -0.09 -0.00 0.00 -1.58 0.00 0.00 32.23 31.01 1be3 h LYS 231 CO 0.02 0.50 -0.05 0.77 -1.08 0.00 0.00 179.45 179.61 1be3 h SER 232 N 0.53 0.00 -3.31 0.86 0.02 -1.08 -3.47 113.55 107.10 1be3 h SER 232 Ca 0.12 0.00 -0.57 0.00 -0.84 0.00 0.00 61.79 60.50 1be3 h SER 232 Cb 0.22 0.00 0.13 0.00 0.14 0.00 0.00 62.40 62.89 1be3 h SER 232 CO -0.00 0.05 0.27 0.54 -1.14 0.00 0.00 176.83 176.55 1be3 n ARG 233 N -3.15 1.47 -4.38 3.45 1.74 -0.83 -5.05 116.66 109.91 1be3 n ARG 233 Ca 0.01 0.53 -0.20 0.00 -0.77 0.00 0.00 57.85 57.43 1be3 n ARG 233 Cb 0.40 -2.18 -0.14 0.00 -1.02 0.00 0.00 32.46 29.52 1be3 n ARG 233 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1be3 s LYS 234 N -2.20 0.90 0.30 5.56 -0.14 -1.26 -5.06 119.74 117.83 1be3 s LYS 234 Ca 0.65 -0.63 0.08 0.00 -1.36 0.00 0.00 55.97 54.70 1be3 s LYS 234 Cb -0.52 -0.88 -0.03 0.00 -1.68 0.00 0.00 37.83 34.72 1be3 s LYS 234 CO 0.56 0.22 0.21 -0.51 -0.76 0.00 0.00 175.35 175.07 1be3 s LEU 235 N -0.85 3.60 -0.27 3.17 1.43 -1.26 -5.14 118.68 119.37 1be3 s LEU 235 Ca 0.02 -0.45 -0.14 0.00 -1.03 0.00 0.00 54.13 52.53 1be3 s LEU 235 Cb -0.07 -2.16 0.09 0.00 0.03 0.00 0.00 46.19 44.08 1be3 s LEU 235 CO 0.01 -0.19 0.65 0.00 0.23 0.00 0.00 176.35 177.04 1be3 s ALA 236 N -2.26 -1.80 -0.18 4.21 0.00 -1.26 -5.15 121.76 115.32 1be3 s ALA 236 Ca 0.37 2.30 -0.00 0.00 0.00 0.00 0.00 51.96 54.62 1be3 s ALA 236 Cb -0.06 -1.43 0.01 0.00 0.00 0.00 0.00 23.12 21.64 1be3 s ALA 236 CO 0.25 -0.46 -0.15 -0.47 0.00 0.00 0.00 175.76 174.93 1be3 s TYR 237 N 1.82 2.82 -0.45 0.00 5.04 -1.26 -5.05 117.35 120.27 1be3 s TYR 237 Ca -0.09 -1.28 0.09 0.00 -2.44 0.00 0.00 57.07 53.35 1be3 s TYR 237 Cb -0.07 -1.95 0.33 0.00 0.35 0.00 0.00 41.96 40.63 1be3 s TYR 237 CO -0.19 -0.64 0.78 0.54 -1.34 0.00 0.00 175.55 174.71 1be3 n ARG 238 N 4.47 1.72 -1.12 4.97 1.74 -1.26 -5.13 116.66 122.05 1be3 n ARG 238 Ca -0.20 -3.88 -0.36 0.00 -0.77 0.00 0.00 57.85 52.64 1be3 n ARG 238 Cb 0.51 -1.86 0.06 0.00 -1.02 0.00 0.00 32.46 30.15 1be3 n ARG 238 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1be3 n PRO 239 N 0.23 0.08 0.07 5.56 -0.04 -1.26 -4.89 135.00 134.76 1be3 n PRO 239 Ca 0.27 0.05 -0.06 0.00 -0.04 0.00 0.00 63.50 63.72 1be3 n PRO 239 Cb 0.56 -1.45 0.10 0.00 -0.04 0.00 0.00 33.50 32.66 1be3 n PRO 239 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 1be3 h PRO 240 N -0.64 0.28 0.00 0.54 0.13 -2.08 -3.57 132.00 126.66 1be3 h PRO 240 Ca -0.44 -0.20 0.00 0.00 -0.87 0.00 0.00 66.00 64.49 1be3 h PRO 240 Cb 1.35 0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.51 1be3 h PRO 240 CO 0.36 0.82 0.00 1.17 -0.23 0.00 0.00 178.00 180.12