#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dkw s GLU 2 N 0.00 2.93 -0.22 0.03 8.01 -1.26 -4.90 118.70 123.30 3dkw s GLU 2 Ca 0.00 -0.26 -0.03 0.00 0.01 0.00 0.00 54.97 54.69 3dkw s GLU 2 Cb 0.00 -4.81 0.11 0.00 -4.31 0.00 0.00 34.13 25.12 3dkw s GLU 2 CO 0.00 -2.72 0.28 -0.06 0.01 0.00 0.00 175.26 172.77 3dkw s PHE 3 N 7.84 -0.46 0.11 1.61 0.08 -1.26 -4.97 117.98 120.93 3dkw s PHE 3 Ca 0.57 0.41 0.05 0.00 0.12 0.00 0.00 56.93 58.08 3dkw s PHE 3 Cb -0.07 -0.24 -0.04 0.00 -0.57 0.00 0.00 43.02 42.11 3dkw s PHE 3 CO 0.05 -0.65 -0.12 -0.65 -0.10 0.00 0.00 175.22 173.76 3dkw s GLN 4 N 2.40 0.94 0.29 0.44 -0.21 -1.26 -5.04 119.66 117.22 3dkw s GLN 4 Ca 0.09 -1.22 0.25 0.00 0.02 0.00 0.00 55.36 54.49 3dkw s GLN 4 Cb -0.16 -0.69 0.54 0.00 1.00 0.00 0.00 33.01 33.70 3dkw s GLN 4 CO -0.14 0.12 1.62 0.00 -2.12 0.00 0.00 175.29 174.77 3dkw h ARG 5 N 3.45 0.00 -0.01 2.91 3.08 -2.01 -3.26 114.38 118.54 3dkw h ARG 5 Ca -0.38 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 59.47 3dkw h ARG 5 Cb 1.19 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.24 3dkw h ARG 5 CO 0.53 0.00 -0.86 0.28 -1.07 0.00 0.00 179.97 178.85 3dkw h VAL 6 N 0.00 1.44 -0.00 2.04 2.07 -2.00 -3.07 116.25 116.73 3dkw h VAL 6 Ca 0.00 -2.47 -0.17 0.00 0.82 0.00 0.00 66.70 64.89 3dkw h VAL 6 Cb 0.86 2.38 -0.02 0.00 -1.52 0.00 0.00 31.29 32.98 3dkw h VAL 6 CO 0.00 0.73 -0.79 0.45 0.02 0.00 0.00 177.57 177.98 3dkw h HIS 7 N 0.17 0.09 0.00 1.57 3.86 -1.99 -3.22 115.15 115.63 3dkw h HIS 7 Ca -0.05 -0.05 0.00 0.00 -1.16 0.00 0.00 60.37 59.11 3dkw h HIS 7 Cb 1.48 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.94 3dkw h HIS 7 CO 0.04 0.82 -0.17 1.04 0.86 0.00 0.00 177.93 180.52 3dkw n GLN 8 N -3.65 0.19 0.15 2.45 6.02 -1.22 -3.62 117.38 117.70 3dkw n GLN 8 Ca -0.02 0.13 0.12 0.00 -0.01 0.00 0.00 57.00 57.22 3dkw n GLN 8 Cb 0.75 -1.69 0.08 0.00 1.02 0.00 0.00 30.24 30.40 3dkw n GLN 8 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 177.06 176.42 3dkw h GLN 9 N 0.00 0.00 0.02 -1.09 4.15 -1.54 -3.26 115.11 113.39 3dkw h GLN 9 Ca 0.00 0.00 -0.22 0.00 0.77 0.00 0.00 58.65 59.20 3dkw h GLN 9 Cb 0.67 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.34 3dkw h GLN 9 CO 0.00 0.00 -1.02 -0.07 -1.93 0.00 0.00 178.83 175.81 3dkw h LEU 10 N 0.00 0.07 -0.88 -2.39 3.38 -1.67 -3.25 115.31 110.56 3dkw h LEU 10 Ca 0.00 -0.07 -0.08 0.00 0.09 0.00 0.00 57.88 57.82 3dkw h LEU 10 Cb 0.99 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.70 3dkw h LEU 10 CO 0.00 1.04 -0.39 -0.07 0.09 0.00 0.00 178.44 179.11 3dkw h LEU 11 N 0.01 0.00 -1.33 1.67 3.38 -1.70 -3.07 115.31 114.28 3dkw h LEU 11 Ca -0.03 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 3dkw h LEU 11 Cb 1.77 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.51 3dkw h LEU 11 CO 0.14 0.39 -0.28 -0.61 0.09 0.00 0.00 178.44 178.17 3dkw h GLN 12 N 0.00 0.08 0.00 1.13 4.15 -1.60 -2.39 115.11 116.49 3dkw h GLN 12 Ca -0.00 -0.03 -0.12 0.00 0.77 0.00 0.00 58.65 59.27 3dkw h GLN 12 Cb 0.93 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.60 3dkw h GLN 12 CO 0.05 0.36 -0.58 0.77 -1.93 0.00 0.00 178.83 177.51 3dkw h SER 13 N 0.08 0.00 -4.20 -0.69 0.02 -1.66 -3.37 113.55 103.72 3dkw h SER 13 Ca 0.01 0.00 -0.49 0.00 -0.84 0.00 0.00 61.79 60.47 3dkw h SER 13 Cb 0.54 0.00 0.05 0.00 0.14 0.00 0.00 62.40 63.13 3dkw h SER 13 CO 0.04 0.58 0.38 -2.28 -1.14 0.00 0.00 176.83 174.40 3dkw s HIS 14 N -3.67 3.14 0.01 3.45 5.65 -0.90 -4.95 115.29 118.02 3dkw s HIS 14 Ca -0.01 1.49 0.18 0.00 0.25 0.00 0.00 55.06 56.97 3dkw s HIS 14 Cb 0.13 -2.94 0.45 0.00 -1.18 0.00 0.00 32.58 29.04 3dkw s HIS 14 CO 0.75 -0.89 1.62 1.12 -0.65 0.00 0.00 174.74 176.69 3dkw h HIS 15 N 0.54 0.00 0.00 3.88 2.07 -1.86 -2.30 115.15 117.48 3dkw h HIS 15 Ca -0.47 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.05 3dkw h HIS 15 Cb 1.21 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.19 3dkw h HIS 15 CO 0.60 0.40 0.00 -0.07 -3.07 0.00 0.00 177.93 175.79 3dkw h LEU 16 N 0.00 0.00 -2.34 6.12 3.38 -1.93 -3.26 115.31 117.28 3dkw h LEU 16 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3dkw h LEU 16 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 3dkw h LEU 16 CO 0.05 0.00 -0.12 0.49 0.09 0.00 0.00 178.44 178.95 3dkw n PHE 17 N -2.54 0.00 0.14 1.13 3.01 -1.19 -4.81 117.46 113.19 3dkw n PHE 17 Ca 0.04 -0.42 -0.07 0.00 1.01 0.00 0.00 57.45 58.01 3dkw n PHE 17 Cb 0.40 -0.07 -0.03 0.00 -0.01 0.00 0.00 39.48 39.77 3dkw n PHE 17 CO 0.00 0.00 0.00 1.49 1.01 0.00 0.00 176.76 179.26 3dkw h GLU 18 N 0.00 -0.41 0.00 -1.08 4.57 -1.46 -3.34 114.58 112.86 3dkw h GLU 18 Ca 0.00 0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.18 3dkw h GLU 18 Cb 0.97 0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 29.65 3dkw h GLU 18 CO 0.00 -0.28 -0.11 -1.35 -1.18 0.00 0.00 179.01 176.09 3dkw h PRO 19 N -1.08 0.00 -6.86 0.92 0.11 -1.88 -3.45 132.00 119.77 3dkw h PRO 19 Ca -0.04 0.00 -0.53 0.00 0.11 0.00 0.00 66.00 65.53 3dkw h PRO 19 Cb 0.33 0.00 0.09 0.00 0.11 0.00 0.00 31.00 31.52 3dkw h PRO 19 CO 0.07 0.11 0.78 -0.51 -0.21 0.00 0.00 178.00 178.25 3dkw s LEU 20 N -6.80 4.35 0.46 2.35 1.43 -1.25 -4.96 118.68 114.27 3dkw s LEU 20 Ca -0.01 2.90 -0.14 0.00 -1.03 0.00 0.00 54.13 55.85 3dkw s LEU 20 Cb 0.11 -3.65 -0.07 0.00 0.03 0.00 0.00 46.19 42.61 3dkw s LEU 20 CO 0.57 -0.80 0.89 -0.94 0.23 0.00 0.00 176.35 176.30 3dkw s SER 21 N 0.07 6.58 0.55 2.29 1.04 -1.26 -4.84 113.70 118.12 3dkw s SER 21 Ca 0.56 1.37 0.32 0.00 0.48 0.00 0.00 55.95 58.68 3dkw s SER 21 Cb -0.45 -2.43 1.48 0.00 0.10 0.00 0.00 66.02 64.72 3dkw s SER 21 CO 0.54 -0.50 1.87 -0.65 0.98 0.00 0.00 173.24 175.47 3dkw h PRO 22 N 1.07 0.00 -0.16 4.02 0.11 -1.97 0.15 132.00 135.22 3dkw h PRO 22 Ca -0.47 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.52 3dkw h PRO 22 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3dkw h PRO 22 CO 0.63 0.00 -0.36 0.28 -0.21 0.00 0.00 178.00 178.33 3dkw h VAL 23 N 0.00 1.35 0.00 3.15 2.07 -2.00 -2.20 116.25 118.62 3dkw h VAL 23 Ca 0.41 -1.62 -0.06 0.00 0.82 0.00 0.00 66.70 66.25 3dkw h VAL 23 Cb 1.73 1.97 -0.01 0.00 -1.52 0.00 0.00 31.29 33.46 3dkw h VAL 23 CO -0.00 0.49 -0.30 1.56 0.02 0.00 0.00 177.57 179.34 3dkw h GLN 24 N 0.17 0.00 0.04 1.57 1.08 -1.35 -3.07 115.11 113.54 3dkw h GLN 24 Ca 0.00 0.00 -0.22 0.00 -1.45 0.00 0.00 58.65 56.98 3dkw h GLN 24 Cb 0.96 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.39 3dkw h GLN 24 CO 0.08 0.30 -1.00 1.25 -0.95 0.00 0.00 178.83 178.51 3dkw h LEU 25 N 0.00 0.33 -0.35 1.46 5.85 -0.80 -2.95 115.31 118.85 3dkw h LEU 25 Ca -0.00 -0.30 -0.19 0.00 0.84 0.00 0.00 57.88 58.23 3dkw h LEU 25 Cb 1.14 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 42.06 3dkw h LEU 25 CO 0.04 1.14 -0.75 -0.61 -0.34 0.00 0.00 178.44 177.92 3dkw h GLN 26 N 0.11 0.47 0.00 1.25 4.15 -1.41 -2.95 115.11 116.73 3dkw h GLN 26 Ca -0.07 -0.39 -0.11 0.00 0.77 0.00 0.00 58.65 58.85 3dkw h GLN 26 Cb 1.67 0.08 -0.02 0.00 0.21 0.00 0.00 27.48 29.42 3dkw h GLN 26 CO 0.16 1.03 -0.51 1.49 -1.93 0.00 0.00 178.83 179.06 3dkw h GLU 27 N 0.32 0.00 -0.03 1.69 4.81 -1.59 -2.97 114.58 116.81 3dkw h GLU 27 Ca -0.04 0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.02 3dkw h GLU 27 Cb 1.34 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.70 3dkw h GLU 27 CO 0.13 0.51 -0.76 1.25 -0.73 0.00 0.00 179.01 179.42 3dkw h LEU 28 N 0.00 0.25 -0.57 1.64 5.85 -1.48 -3.07 115.31 117.93 3dkw h LEU 28 Ca -0.01 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.54 3dkw h LEU 28 Cb 0.98 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.93 3dkw h LEU 28 CO 0.07 0.91 0.00 -0.07 -0.34 0.00 0.00 178.44 179.01 3dkw h LEU 29 N 0.13 0.00 -0.80 2.25 3.38 -1.40 -3.09 115.31 115.79 3dkw h LEU 29 Ca -0.03 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.83 3dkw h LEU 29 Cb 1.33 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.07 3dkw h LEU 29 CO 0.12 0.00 -0.34 0.00 0.09 0.00 0.00 178.44 178.31 3dkw h ALA 30 N 2.08 0.97 -0.00 1.53 0.00 -1.42 -2.85 119.26 119.57 3dkw h ALA 30 Ca 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.51 3dkw h ALA 30 Cb 0.75 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3dkw h ALA 30 CO 0.00 0.61 -0.42 -1.13 0.00 0.00 0.00 179.25 178.30 3dkw n SER 31 N -4.06 0.89 -4.90 0.00 3.41 -1.20 -4.92 113.62 102.83 3dkw n SER 31 Ca -0.01 -0.69 -0.28 0.00 -0.26 0.00 0.00 58.87 57.63 3dkw n SER 31 Cb 0.47 0.27 0.00 0.00 -0.26 0.00 0.00 64.21 64.69 3dkw n SER 31 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3dkw s SER 32 N -2.73 6.17 0.00 4.04 1.04 -1.08 -4.56 113.70 116.59 3dkw s SER 32 Ca 0.17 0.95 0.02 0.00 0.48 0.00 0.00 55.95 57.57 3dkw s SER 32 Cb 0.18 -2.20 -0.01 0.00 0.10 0.00 0.00 66.02 64.10 3dkw s SER 32 CO 0.62 -0.67 -0.06 -0.62 0.98 0.00 0.00 173.24 173.49 3dkw s ASP 33 N -4.14 0.71 0.00 7.02 2.15 -0.88 -4.97 116.67 116.55 3dkw s ASP 33 Ca 0.49 -0.17 0.00 0.00 0.43 0.00 0.00 52.55 53.30 3dkw s ASP 33 Cb -0.10 -0.06 0.00 0.00 -0.30 0.00 0.00 42.92 42.46 3dkw s ASP 33 CO 0.46 0.03 0.00 0.18 -0.17 0.00 0.00 175.17 175.67 3dkw n LEU 34 N 2.72 0.00 -0.90 -1.34 4.32 -1.26 -1.24 117.00 119.31 3dkw n LEU 34 Ca -0.14 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.85 3dkw n LEU 34 Cb 0.58 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.38 3dkw n LEU 34 CO 0.25 0.00 0.00 0.52 -1.22 0.00 0.00 177.39 176.94 3dkw n VAL 35 N 0.00 -1.96 -4.21 4.08 0.31 -1.26 -3.91 118.33 111.38 3dkw n VAL 35 Ca 0.00 0.00 -0.35 0.00 -0.01 0.00 0.00 64.34 63.98 3dkw n VAL 35 Cb 0.00 -2.77 -0.09 0.00 -0.91 0.00 0.00 33.84 30.07 3dkw n VAL 35 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 3dkw s ASN 36 N 0.00 5.51 -0.05 4.52 -0.87 -1.26 -3.99 114.94 118.80 3dkw s ASN 36 Ca 0.00 0.18 0.06 0.00 -1.57 0.00 0.00 52.86 51.53 3dkw s ASN 36 Cb 0.00 -1.71 -0.01 0.00 -0.02 0.00 0.00 41.25 39.51 3dkw s ASN 36 CO 0.00 0.33 -0.25 -0.76 -2.57 0.00 0.00 177.10 173.85 3dkw s LEU 37 N -0.58 2.09 0.00 0.60 1.43 -1.04 -5.07 118.68 116.11 3dkw s LEU 37 Ca 0.10 -0.49 0.00 0.00 -1.03 0.00 0.00 54.13 52.71 3dkw s LEU 37 Cb -0.12 -1.38 0.00 0.00 0.03 0.00 0.00 46.19 44.73 3dkw s LEU 37 CO 0.02 0.26 0.01 -0.67 0.23 0.00 0.00 176.35 176.20 3dkw n ASP 38 N 2.86 0.01 -4.71 2.29 -0.08 -1.26 -1.24 116.55 114.42 3dkw n ASP 38 Ca -0.17 -1.01 -0.42 0.00 -1.51 0.00 0.00 54.79 51.68 3dkw n ASP 38 Cb 0.52 -0.00 -0.03 0.00 2.34 0.00 0.00 41.12 43.94 3dkw n ASP 38 CO 0.00 0.00 0.00 -1.59 0.12 0.00 0.00 177.20 175.73 3dkw s LYS 39 N -2.12 4.37 -0.12 -0.67 -2.85 -1.26 -3.03 119.74 114.06 3dkw s LYS 39 Ca 0.00 1.89 0.00 0.00 -1.00 0.00 0.00 55.97 56.86 3dkw s LYS 39 Cb -0.00 -3.35 0.00 0.00 -2.06 0.00 0.00 37.83 32.42 3dkw s LYS 39 CO 0.00 -0.36 0.00 0.41 0.10 0.00 0.00 175.35 175.50 3dkw n GLY 40 N 3.36 0.33 3.77 0.59 0.00 0.08 -4.97 105.19 108.35 3dkw n GLY 40 Ca 0.10 -0.85 -0.35 0.00 0.00 0.00 0.00 46.02 44.93 3dkw n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dkw s ALA 41 N -2.07 3.55 -0.00 4.61 0.00 -1.17 -4.93 121.76 121.75 3dkw s ALA 41 Ca 0.00 -0.79 -0.22 0.00 0.00 0.00 0.00 51.96 50.95 3dkw s ALA 41 Cb 0.00 -1.64 -0.05 0.00 0.00 0.00 0.00 23.12 21.42 3dkw s ALA 41 CO 0.00 0.64 0.65 0.71 0.00 0.00 0.00 175.76 177.75 3dkw s TYR 42 N -1.04 3.68 -0.18 0.00 1.51 -1.26 -1.29 117.35 118.76 3dkw s TYR 42 Ca 0.17 1.27 -0.24 0.00 -1.01 0.00 0.00 57.07 57.26 3dkw s TYR 42 Cb -0.12 -2.68 -0.21 0.00 -0.11 0.00 0.00 41.96 38.84 3dkw s TYR 42 CO 0.07 0.30 0.41 0.28 -1.11 0.00 0.00 175.55 175.50 3dkw h VAL 43 N 4.21 1.23 -2.02 0.71 2.07 -1.68 -3.49 116.25 117.27 3dkw h VAL 43 Ca -0.44 -2.22 -0.04 0.00 0.82 0.00 0.00 66.70 64.81 3dkw h VAL 43 Cb 1.20 2.62 -0.21 0.00 -1.52 0.00 0.00 31.29 33.38 3dkw h VAL 43 CO 0.71 0.42 0.12 0.72 0.02 0.00 0.00 177.57 179.55 3dkw s PHE 44 N -2.30 -0.79 0.27 1.57 -0.71 -1.24 -5.01 117.98 109.77 3dkw s PHE 44 Ca -0.25 1.91 0.01 0.00 -1.04 0.00 0.00 56.93 57.56 3dkw s PHE 44 Cb 0.03 0.28 -0.04 0.00 -1.21 0.00 0.00 43.02 42.08 3dkw s PHE 44 CO 0.62 -0.38 0.45 1.03 -1.34 0.00 0.00 175.22 175.60 3dkw s ARG 45 N 0.41 3.49 -0.02 1.99 0.52 -1.26 -1.61 118.95 122.46 3dkw s ARG 45 Ca -0.00 -0.44 -0.30 0.00 -0.52 0.00 0.00 55.73 54.47 3dkw s ARG 45 Cb -0.05 -2.77 -0.03 0.00 0.52 0.00 0.00 34.95 32.61 3dkw s ARG 45 CO 0.00 0.30 1.10 -1.14 0.02 0.00 0.00 175.30 175.58 3dkw s GLN 46 N -3.91 4.44 0.00 3.54 0.74 -1.26 -3.00 119.66 120.20 3dkw s GLN 46 Ca 0.38 1.57 0.00 0.00 0.05 0.00 0.00 55.36 57.36 3dkw s GLN 46 Cb -0.10 -3.48 0.00 0.00 1.10 0.00 0.00 33.01 30.53 3dkw s GLN 46 CO 0.32 -0.27 0.00 0.41 -0.55 0.00 0.00 175.29 175.20 3dkw n GLY 47 N 3.15 2.05 3.89 2.59 0.00 -1.24 -5.01 105.19 110.61 3dkw n GLY 47 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 3dkw n GLY 47 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dkw s GLU 48 N -0.54 3.73 0.43 1.61 2.02 -1.16 -4.78 118.70 120.01 3dkw s GLU 48 Ca 0.00 0.27 -0.24 0.00 0.02 0.00 0.00 54.97 55.02 3dkw s GLU 48 Cb 0.00 -2.52 -0.08 0.00 0.10 0.00 0.00 34.13 31.63 3dkw s GLU 48 CO 0.00 0.11 1.21 -1.25 0.02 0.00 0.00 175.26 175.36 3dkw s PRO 49 N -3.58 3.86 0.00 0.39 0.04 -1.26 -0.67 135.00 133.78 3dkw s PRO 49 Ca 0.48 1.92 0.00 0.00 0.04 0.00 0.00 61.00 63.44 3dkw s PRO 49 Cb -0.11 -2.57 0.00 0.00 0.04 0.00 0.00 34.50 31.86 3dkw s PRO 49 CO 0.29 -0.51 0.00 0.00 0.04 0.00 0.00 177.00 176.82 3dkw n ALA 50 N -0.18 0.00 0.00 8.56 0.00 -1.14 -4.78 120.51 122.97 3dkw n ALA 50 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 3dkw n ALA 50 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 3dkw n ALA 50 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3dkw n HIS 51 N 0.00 0.00 -3.64 0.00 8.25 -1.26 -4.92 115.22 113.65 3dkw n HIS 51 Ca 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.35 3dkw n HIS 51 Cb 0.00 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.04 3dkw n HIS 51 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3dkw s ALA 52 N -1.81 -1.89 0.32 -1.41 0.00 -1.26 -0.25 121.76 115.46 3dkw s ALA 52 Ca 0.00 2.07 0.08 0.00 0.00 0.00 0.00 51.96 54.12 3dkw s ALA 52 Cb 0.00 -1.34 -0.04 0.00 0.00 0.00 0.00 23.12 21.74 3dkw s ALA 52 CO 0.00 -0.32 0.13 -0.59 0.00 0.00 0.00 175.76 174.99 3dkw s PHE 53 N 0.64 2.76 0.17 0.00 -0.71 -0.38 -4.84 117.98 115.62 3dkw s PHE 53 Ca -0.02 -0.32 0.11 0.00 -1.04 0.00 0.00 56.93 55.67 3dkw s PHE 53 Cb -0.05 -1.54 -0.04 0.00 -1.21 0.00 0.00 43.02 40.17 3dkw s PHE 53 CO -0.06 0.40 -0.24 0.71 -1.34 0.00 0.00 175.22 174.69 3dkw s TYR 54 N -2.36 2.33 -0.13 3.49 1.51 -1.25 -2.14 117.35 118.80 3dkw s TYR 54 Ca 0.36 -0.35 0.00 0.00 -1.01 0.00 0.00 57.07 56.07 3dkw s TYR 54 Cb -0.04 -1.20 0.02 0.00 -0.11 0.00 0.00 41.96 40.64 3dkw s TYR 54 CO 0.23 0.44 -0.11 -0.47 -1.11 0.00 0.00 175.55 174.53 3dkw s TYR 55 N -1.44 1.83 -0.05 2.71 6.14 -1.11 -3.35 117.35 122.09 3dkw s TYR 55 Ca 0.18 -0.97 -0.21 0.00 0.64 0.00 0.00 57.07 56.72 3dkw s TYR 55 Cb -0.09 -1.41 -0.05 0.00 0.42 0.00 0.00 41.96 40.84 3dkw s TYR 55 CO 0.09 -0.58 0.59 -1.17 0.64 0.00 0.00 175.55 175.12 3dkw s LEU 56 N 1.54 4.36 -0.21 6.97 2.96 -1.14 -1.27 118.68 131.89 3dkw s LEU 56 Ca 0.04 1.08 -0.17 0.00 -0.22 0.00 0.00 54.13 54.86 3dkw s LEU 56 Cb -0.13 -2.90 -0.19 0.00 0.50 0.00 0.00 46.19 43.47 3dkw s LEU 56 CO -0.09 0.03 0.13 -0.38 -1.32 0.00 0.00 176.35 174.72 3dkw n ILE 57 N 3.21 1.58 -3.65 6.68 -0.00 -0.99 -2.27 119.36 123.91 3dkw n ILE 57 Ca -0.06 -0.22 -0.06 0.00 -0.00 0.00 0.00 62.75 62.41 3dkw n ILE 57 Cb 0.51 -1.94 -0.07 0.00 -0.00 0.00 0.00 39.64 38.15 3dkw n ILE 57 CO 0.00 0.00 0.00 -0.55 -0.00 0.00 0.00 176.55 176.00 3dkw s SER 58 N -6.98 -0.88 0.00 4.38 0.15 -1.25 -3.62 113.70 105.50 3dkw s SER 58 Ca -0.30 1.40 0.00 0.00 0.70 0.00 0.00 55.95 57.75 3dkw s SER 58 Cb 0.08 1.49 0.00 0.00 -1.71 0.00 0.00 66.02 65.88 3dkw s SER 58 CO 0.61 -0.23 0.00 0.61 1.20 0.00 0.00 173.24 175.43 3dkw n GLY 59 N 4.64 0.67 2.72 9.45 0.00 -1.26 -3.27 105.19 118.14 3dkw n GLY 59 Ca -0.18 -1.79 -0.19 0.00 0.00 0.00 0.00 46.02 43.85 3dkw n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dkw s VAL 61 N 2.21 1.71 -0.07 0.00 1.01 -1.15 -2.87 120.40 121.24 3dkw s VAL 61 Ca 0.04 -0.77 -0.09 0.00 0.00 0.00 0.00 61.98 61.17 3dkw s VAL 61 Cb -0.12 -1.61 -0.04 0.00 0.00 0.00 0.00 36.38 34.60 3dkw s VAL 61 CO -0.05 0.43 0.22 -1.59 0.00 0.00 0.00 175.10 174.12 3dkw s LYS 62 N 1.42 3.57 -0.19 2.72 -2.85 -0.66 -3.37 119.74 120.39 3dkw s LYS 62 Ca 0.04 -0.01 0.01 0.00 -1.00 0.00 0.00 55.97 55.02 3dkw s LYS 62 Cb -0.13 -3.18 0.02 0.00 -2.06 0.00 0.00 37.83 32.48 3dkw s LYS 62 CO -0.11 0.74 -0.19 0.42 0.10 0.00 0.00 175.35 176.31 3dkw s ILE 63 N -1.08 2.09 0.14 3.79 1.01 -1.25 -1.00 121.20 124.89 3dkw s ILE 63 Ca 0.19 -0.98 0.03 0.00 0.00 0.00 0.00 60.65 59.88 3dkw s ILE 63 Cb -0.13 -1.90 -0.04 0.00 0.01 0.00 0.00 42.46 40.40 3dkw s ILE 63 CO 0.08 0.50 0.22 -0.72 0.00 0.00 0.00 174.94 175.02 3dkw s TYR 64 N 1.28 3.38 -0.40 3.97 1.13 -0.32 -1.43 117.35 124.95 3dkw s TYR 64 Ca 0.04 0.10 0.20 0.00 -1.41 0.00 0.00 57.07 56.00 3dkw s TYR 64 Cb -0.14 -1.63 -0.28 0.00 -1.10 0.00 0.00 41.96 38.81 3dkw s TYR 64 CO -0.12 0.53 0.61 -2.13 -2.51 0.00 0.00 175.55 171.93 3dkw n ARG 65 N -0.31 0.52 -1.96 -3.49 0.00 0.26 -1.58 116.66 110.10 3dkw n ARG 65 Ca -0.07 -0.11 -0.01 0.00 -0.00 0.00 0.00 57.85 57.66 3dkw n ARG 65 Cb 0.54 -1.48 -0.01 0.00 0.00 0.00 0.00 32.46 31.51 3dkw n ARG 65 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 3dkw n LEU 66 N -1.92 -4.97 -4.92 6.15 4.77 -1.26 -4.88 117.00 109.96 3dkw n LEU 66 Ca -0.01 1.80 -0.26 0.00 -0.03 0.00 0.00 56.01 57.51 3dkw n LEU 66 Cb 0.45 -2.48 -0.01 0.00 -2.33 0.00 0.00 43.42 39.05 3dkw n LEU 66 CO 0.42 -2.09 0.29 -0.89 -1.33 0.00 0.00 177.39 173.80 3dkw s THR 67 N -0.40 5.01 0.27 -5.08 2.01 -1.24 -4.87 115.64 111.34 3dkw s THR 67 Ca -0.04 -0.11 -0.26 0.00 0.31 0.00 0.00 61.69 61.58 3dkw s THR 67 Cb 0.00 -3.85 -0.16 0.00 0.01 0.00 0.00 72.50 68.50 3dkw s THR 67 CO 0.12 -0.65 0.42 -2.65 -0.69 0.00 0.00 174.62 171.16 3dkw n PRO 68 N -1.88 0.06 0.00 4.92 -0.02 -1.26 -3.98 135.00 132.84 3dkw n PRO 68 Ca -0.02 0.02 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 3dkw n PRO 68 Cb 0.55 -1.04 0.00 0.00 -0.02 0.00 0.00 33.50 32.99 3dkw n PRO 68 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3dkw n GLU 69 N 1.07 0.00 0.00 -0.52 1.02 -1.26 -4.71 120.64 116.25 3dkw n GLU 69 Ca 0.16 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.30 3dkw n GLU 69 Cb 0.30 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.72 3dkw n GLU 69 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dkw n GLY 70 N 0.00 0.67 1.42 0.62 0.00 -1.26 -5.10 105.19 101.54 3dkw n GLY 70 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 3dkw n GLY 70 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3dkw n GLN 71 N 0.00 -3.52 -3.64 1.61 1.13 -1.26 -3.62 117.38 108.08 3dkw n GLN 71 Ca 0.00 2.80 -0.29 0.00 -1.94 0.00 0.00 57.00 57.57 3dkw n GLN 71 Cb 0.00 -3.72 -0.13 0.00 0.11 0.00 0.00 30.24 26.50 3dkw n GLN 71 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 3dkw s GLU 72 N -4.81 1.12 -0.48 -1.09 2.02 -1.26 -3.76 118.70 110.44 3dkw s GLU 72 Ca 0.00 -1.87 -0.28 0.00 0.02 0.00 0.00 54.97 52.84 3dkw s GLU 72 Cb 0.00 -2.07 0.01 0.00 0.10 0.00 0.00 34.13 32.17 3dkw s GLU 72 CO 0.00 -1.18 1.40 0.21 0.02 0.00 0.00 175.26 175.71 3dkw s LYS 73 N 0.49 3.46 0.03 1.61 2.20 -1.26 -4.83 119.74 121.44 3dkw s LYS 73 Ca 0.18 0.71 -0.30 0.00 -0.36 0.00 0.00 55.97 56.19 3dkw s LYS 73 Cb -0.23 -4.06 -0.05 0.00 -1.51 0.00 0.00 37.83 31.98 3dkw s LYS 73 CO -0.00 -1.72 1.22 0.42 -0.36 0.00 0.00 175.35 174.90 3dkw s ILE 74 N 5.67 4.03 0.00 5.43 -1.09 -1.26 0.92 121.20 134.91 3dkw s ILE 74 Ca 0.57 1.44 0.00 0.00 -2.23 0.00 0.00 60.65 60.43 3dkw s ILE 74 Cb -0.12 -3.92 0.00 0.00 -1.58 0.00 0.00 42.46 36.84 3dkw s ILE 74 CO 0.29 0.08 0.00 0.18 -1.23 0.00 0.00 174.94 174.26 3dkw n LEU 75 N 4.30 0.31 -4.34 2.97 4.77 -0.52 -4.92 117.00 119.58 3dkw n LEU 75 Ca 0.10 0.17 -0.29 0.00 -0.03 0.00 0.00 56.01 55.95 3dkw n LEU 75 Cb 0.46 -0.38 -0.14 0.00 -2.33 0.00 0.00 43.42 41.02 3dkw n LEU 75 CO 0.56 -0.38 -0.56 -1.83 -1.33 0.00 0.00 177.39 173.84 3dkw s GLU 76 N -0.76 1.70 -0.34 3.23 -1.05 -1.26 -5.07 118.70 115.15 3dkw s GLU 76 Ca 0.00 -1.12 -0.12 0.00 -0.15 0.00 0.00 54.97 53.57 3dkw s GLU 76 Cb 0.00 -1.92 -0.01 0.00 -0.44 0.00 0.00 34.13 31.76 3dkw s GLU 76 CO 0.00 0.49 0.23 0.08 0.95 0.00 0.00 175.26 177.01 3dkw s VAL 77 N -0.84 5.13 -0.23 1.83 1.01 -1.26 -3.85 120.40 122.19 3dkw s VAL 77 Ca 0.12 -0.30 -0.10 0.00 0.00 0.00 0.00 61.98 61.70 3dkw s VAL 77 Cb -0.10 -3.65 -0.05 0.00 0.00 0.00 0.00 36.38 32.58 3dkw s VAL 77 CO 0.03 -0.02 0.14 -0.89 0.00 0.00 0.00 175.10 174.35 3dkw s THR 78 N 1.69 5.19 0.00 3.92 2.01 -1.22 -5.07 115.64 122.17 3dkw s THR 78 Ca 0.06 0.12 0.00 0.00 0.31 0.00 0.00 61.69 62.18 3dkw s THR 78 Cb -0.17 -3.41 0.00 0.00 0.01 0.00 0.00 72.50 68.92 3dkw s THR 78 CO 0.10 0.36 0.00 0.59 -0.69 0.00 0.00 174.62 174.98 3dkw n ASN 79 N 4.22 0.86 -4.75 3.53 3.02 -1.26 -2.94 115.26 117.93 3dkw n ASN 79 Ca -0.15 -0.80 -0.34 0.00 -0.03 0.00 0.00 54.58 53.25 3dkw n ASN 79 Cb 0.52 0.00 0.05 0.00 -0.61 0.00 0.00 39.78 39.74 3dkw n ASN 79 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 3dkw s GLU 80 N -1.18 2.74 -1.38 3.52 -1.05 -1.24 -3.44 118.70 116.68 3dkw s GLU 80 Ca 0.00 1.63 -0.07 0.00 -0.15 0.00 0.00 54.97 56.37 3dkw s GLU 80 Cb 0.00 -1.92 0.03 0.00 -0.44 0.00 0.00 34.13 31.80 3dkw s GLU 80 CO 0.00 -1.34 0.99 0.54 0.95 0.00 0.00 175.26 176.40 3dkw n ARG 81 N -2.14 -6.35 -3.75 -4.83 1.74 -0.96 -5.00 116.66 95.37 3dkw n ARG 81 Ca 0.12 0.72 -0.13 0.00 -0.77 0.00 0.00 57.85 57.79 3dkw n ARG 81 Cb 0.51 -5.61 -0.10 0.00 -1.02 0.00 0.00 32.46 26.24 3dkw n ARG 81 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 3dkw s ASN 82 N -3.71 -0.33 -0.10 0.55 0.01 -1.22 -5.04 114.94 105.10 3dkw s ASN 82 Ca 0.39 0.57 -0.06 0.00 -0.71 0.00 0.00 52.86 53.05 3dkw s ASN 82 Cb -0.18 0.63 -0.04 0.00 0.41 0.00 0.00 41.25 42.06 3dkw s ASN 82 CO 0.78 -0.20 0.15 0.42 -1.51 0.00 0.00 177.10 176.74 3dkw s THR 83 N -0.16 5.48 -0.02 1.60 -4.23 -1.26 -2.90 115.64 114.14 3dkw s THR 83 Ca -0.03 0.13 0.05 0.00 -1.18 0.00 0.00 61.69 60.65 3dkw s THR 83 Cb -0.03 -3.42 -0.01 0.00 1.34 0.00 0.00 72.50 70.38 3dkw s THR 83 CO 0.01 0.56 -0.15 0.72 -0.54 0.00 0.00 174.62 175.22 3dkw s PHE 84 N -1.09 1.44 -0.82 3.99 -0.71 -1.21 -4.78 117.98 114.79 3dkw s PHE 84 Ca 0.17 -0.31 -0.05 0.00 -1.04 0.00 0.00 56.93 55.70 3dkw s PHE 84 Cb -0.12 -0.94 0.01 0.00 -1.21 0.00 0.00 43.02 40.75 3dkw s PHE 84 CO 0.07 -0.06 0.71 0.00 -1.34 0.00 0.00 175.22 174.60 3dkw n ALA 85 N 2.85 -0.79 1.20 1.99 0.00 -1.26 -3.97 120.51 120.54 3dkw n ALA 85 Ca -0.16 0.25 0.13 0.00 0.00 0.00 0.00 53.44 53.66 3dkw n ALA 85 Cb 0.54 -3.53 0.27 0.00 0.00 0.00 0.00 19.45 16.74 3dkw n ALA 85 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 3dkw n GLU 86 N -3.21 1.33 0.00 0.00 0.00 -1.26 -3.89 120.64 113.61 3dkw n GLU 86 Ca 0.00 -0.94 0.13 0.00 0.00 0.00 0.00 57.16 56.36 3dkw n GLU 86 Cb 0.54 -1.48 0.48 0.00 0.00 0.00 0.00 31.44 30.98 3dkw n GLU 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3dkw n ALA 87 N -0.02 2.93 0.29 -1.84 0.00 -1.26 -3.74 120.51 116.87 3dkw n ALA 87 Ca 0.13 -0.27 0.18 0.00 0.00 0.00 0.00 53.44 53.48 3dkw n ALA 87 Cb 0.42 -1.28 0.79 0.00 0.00 0.00 0.00 19.45 19.38 3dkw n ALA 87 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 3dkw h MET 88 N 0.36 0.00 0.19 0.00 2.86 -1.95 -3.17 114.93 113.22 3dkw h MET 88 Ca 0.00 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 3dkw h MET 88 Cb 0.44 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.11 3dkw h MET 88 CO 0.00 0.02 -0.09 0.52 1.06 0.00 0.00 176.91 178.42 3dkw h MET 89 N 0.00 -0.24 -1.74 1.72 2.86 -1.86 -3.35 114.93 112.32 3dkw h MET 89 Ca -0.00 0.02 -0.41 0.00 -2.06 0.00 0.00 59.70 57.25 3dkw h MET 89 Cb 0.40 0.06 -0.16 0.00 0.06 0.00 0.00 31.60 31.96 3dkw h MET 89 CO 0.00 -0.16 0.39 1.97 1.06 0.00 0.00 176.91 180.17 3dkw n PHE 90 N -3.63 1.56 -2.23 -0.22 1.16 -1.24 -3.68 117.46 109.18 3dkw n PHE 90 Ca -0.03 -1.97 -0.01 0.00 -1.87 0.00 0.00 57.45 53.58 3dkw n PHE 90 Cb 0.10 -1.18 -0.02 0.00 -1.61 0.00 0.00 39.48 36.78 3dkw n PHE 90 CO 0.00 0.00 0.00 -1.33 -1.87 0.00 0.00 176.76 173.56 3dkw n MET 91 N 0.62 0.00 0.00 3.97 2.81 -1.20 -5.07 117.12 118.25 3dkw n MET 91 Ca 0.40 -1.38 0.00 0.00 -1.81 0.00 0.00 57.70 54.91 3dkw n MET 91 Cb 0.58 0.12 0.00 0.00 -0.71 0.00 0.00 33.22 33.21 3dkw n MET 91 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3dkw n ASP 92 N 0.23 0.00 -2.78 7.83 10.43 -1.24 -4.86 116.55 126.16 3dkw n ASP 92 Ca -0.07 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.29 3dkw n ASP 92 Cb 0.89 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.85 3dkw n ASP 92 CO 0.00 0.00 0.00 0.35 -1.07 0.00 0.00 177.20 176.48 3dkw n THR 93 N 0.00 -1.53 0.10 -3.53 -2.24 -1.26 -4.80 114.28 101.02 3dkw n THR 93 Ca 0.00 0.33 -0.03 0.00 -2.27 0.00 0.00 64.05 62.08 3dkw n THR 93 Cb 0.00 -2.49 0.16 0.00 -2.10 0.00 0.00 70.33 65.91 3dkw n THR 93 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 3dkw h PRO 94 N 3.55 0.17 -5.14 -0.78 0.13 -1.92 -3.43 132.00 124.58 3dkw h PRO 94 Ca 0.00 -0.11 -0.37 0.00 -0.87 0.00 0.00 66.00 64.66 3dkw h PRO 94 Cb 0.67 0.01 -0.14 0.00 0.13 0.00 0.00 31.00 31.67 3dkw h PRO 94 CO 0.00 0.68 -0.69 -0.80 -0.23 0.00 0.00 178.00 176.96 3dkw s ASN 95 N -6.88 1.92 0.84 1.44 -0.87 -1.26 -2.87 114.94 107.25 3dkw s ASN 95 Ca -0.03 -1.10 -0.11 0.00 -1.57 0.00 0.00 52.86 50.04 3dkw s ASN 95 Cb 0.13 -0.02 0.10 0.00 -0.02 0.00 0.00 41.25 41.43 3dkw s ASN 95 CO 0.78 -0.39 1.09 -0.31 -2.57 0.00 0.00 177.10 175.71 3dkw s TYR 96 N -3.32 2.50 0.00 2.20 2.02 0.15 -4.79 117.35 116.12 3dkw s TYR 96 Ca 0.22 1.32 0.00 0.00 -0.37 0.00 0.00 57.07 58.25 3dkw s TYR 96 Cb 0.03 -3.11 0.00 0.00 -0.40 0.00 0.00 41.96 38.48 3dkw s TYR 96 CO 0.05 -2.10 0.11 1.33 -1.57 0.00 0.00 175.55 173.37 3dkw n VAL 97 N -3.69 0.00 -3.93 0.71 0.24 -1.26 -3.65 118.33 106.75 3dkw n VAL 97 Ca 0.08 -0.45 -0.10 0.00 -2.04 0.00 0.00 64.34 61.83 3dkw n VAL 97 Cb 0.55 1.03 -0.10 0.00 -1.47 0.00 0.00 33.84 33.84 3dkw n VAL 97 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3dkw s ALA 98 N -0.68 -0.09 -0.21 2.33 0.00 -1.26 -4.87 121.76 116.97 3dkw s ALA 98 Ca 0.00 -0.45 -0.09 0.00 0.00 0.00 0.00 51.96 51.43 3dkw s ALA 98 Cb 0.00 0.19 -0.04 0.00 0.00 0.00 0.00 23.12 23.26 3dkw s ALA 98 CO 0.00 -0.25 0.10 0.99 0.00 0.00 0.00 175.76 176.60 3dkw s THR 99 N -2.02 4.96 -0.11 0.00 2.01 -0.61 -4.18 115.64 115.69 3dkw s THR 99 Ca -0.10 0.04 -0.05 0.00 0.31 0.00 0.00 61.69 61.88 3dkw s THR 99 Cb -0.05 -3.28 -0.04 0.00 0.01 0.00 0.00 72.50 69.15 3dkw s THR 99 CO -0.02 0.41 0.10 0.00 -0.69 0.00 0.00 174.62 174.42 3dkw s ALA 100 N 0.73 3.70 -0.13 7.40 0.00 -0.64 -1.18 121.76 131.65 3dkw s ALA 100 Ca 0.05 -0.69 -0.08 0.00 0.00 0.00 0.00 51.96 51.24 3dkw s ALA 100 Cb -0.13 -1.83 0.05 0.00 0.00 0.00 0.00 23.12 21.21 3dkw s ALA 100 CO 0.02 0.61 0.33 -1.14 0.00 0.00 0.00 175.76 175.57 3dkw s GLN 101 N -0.98 0.32 -0.07 0.00 0.74 -0.17 -1.62 119.66 117.88 3dkw s GLN 101 Ca 0.14 0.60 -0.21 0.00 0.05 0.00 0.00 55.36 55.94 3dkw s GLN 101 Cb -0.12 -0.01 -0.04 0.00 1.10 0.00 0.00 33.01 33.94 3dkw s GLN 101 CO 0.03 -0.13 0.61 0.00 -0.55 0.00 0.00 175.29 175.25 3dkw s ALA 102 N 1.02 3.41 -0.12 1.58 0.00 -0.41 -1.65 121.76 125.59 3dkw s ALA 102 Ca -0.07 0.01 0.16 0.00 0.00 0.00 0.00 51.96 52.06 3dkw s ALA 102 Cb -0.07 -2.81 -0.09 0.00 0.00 0.00 0.00 23.12 20.14 3dkw s ALA 102 CO -0.08 -0.01 0.99 -0.39 0.00 0.00 0.00 175.76 176.27 3dkw h VAL 103 N 4.61 0.62 -3.98 0.00 -1.51 -1.84 0.28 116.25 114.43 3dkw h VAL 103 Ca -0.42 -2.09 -0.45 0.00 -1.23 0.00 0.00 66.70 62.52 3dkw h VAL 103 Cb 1.19 2.15 -0.23 0.00 -2.13 0.00 0.00 31.29 32.28 3dkw h VAL 103 CO 0.74 0.35 -0.79 0.68 -1.23 0.00 0.00 177.57 177.32 3dkw s VAL 104 N -2.93 1.22 -0.31 7.19 -7.23 -1.25 -4.13 120.40 112.95 3dkw s VAL 104 Ca -0.01 -1.25 -0.38 0.00 -1.81 0.00 0.00 61.98 58.53 3dkw s VAL 104 Cb 0.08 -1.14 -0.14 0.00 0.56 0.00 0.00 36.38 35.75 3dkw s VAL 104 CO 0.80 -0.12 1.99 -2.65 -0.31 0.00 0.00 175.10 174.80 3dkw n PRO 105 N 1.44 1.12 -4.15 4.82 -0.02 -1.26 -4.55 135.00 132.40 3dkw n PRO 105 Ca -0.20 0.37 -0.17 0.00 -2.02 0.00 0.00 63.50 61.48 3dkw n PRO 105 Cb 0.54 -2.26 -0.12 0.00 -0.02 0.00 0.00 33.50 31.64 3dkw n PRO 105 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 3dkw s SER 106 N 5.45 1.51 -0.19 2.55 0.01 -0.37 -4.81 113.70 117.85 3dkw s SER 106 Ca 1.05 -0.60 -0.06 0.00 1.31 0.00 0.00 55.95 57.64 3dkw s SER 106 Cb -0.98 -0.03 -0.03 0.00 0.21 0.00 0.00 66.02 65.19 3dkw s SER 106 CO 0.57 -0.10 0.03 -1.58 0.41 0.00 0.00 173.24 172.57 3dkw s GLN 107 N -1.71 3.81 0.23 12.44 0.74 -1.20 -2.51 119.66 131.45 3dkw s GLN 107 Ca -0.04 -0.43 0.01 0.00 0.05 0.00 0.00 55.36 54.95 3dkw s GLN 107 Cb -0.10 -3.13 -0.05 0.00 1.10 0.00 0.00 33.01 30.83 3dkw s GLN 107 CO 0.02 0.18 0.08 -0.51 -0.55 0.00 0.00 175.29 174.50 3dkw s LEU 108 N 0.60 1.71 0.15 3.68 1.02 -1.26 -2.36 118.68 122.22 3dkw s LEU 108 Ca 0.01 -1.33 0.06 0.00 0.02 0.00 0.00 54.13 52.89 3dkw s LEU 108 Cb -0.14 0.04 -0.04 0.00 0.02 0.00 0.00 46.19 46.07 3dkw s LEU 108 CO 0.02 -0.70 0.02 -0.36 0.02 0.00 0.00 176.35 175.35 3dkw s PHE 109 N -3.77 2.94 -0.66 0.29 0.40 -0.39 -4.45 117.98 112.35 3dkw s PHE 109 Ca 0.35 -0.08 0.05 0.00 -0.60 0.00 0.00 56.93 56.64 3dkw s PHE 109 Cb 0.07 -1.45 0.17 0.00 0.51 0.00 0.00 43.02 42.32 3dkw s PHE 109 CO 0.11 0.50 0.46 0.50 0.70 0.00 0.00 175.22 177.49 3dkw s ARG 110 N -2.77 2.24 0.16 0.44 3.52 -0.37 -2.74 118.95 119.44 3dkw s ARG 110 Ca 0.27 -3.14 -0.28 0.00 -0.13 0.00 0.00 55.73 52.45 3dkw s ARG 110 Cb -0.10 -3.18 -0.07 0.00 -1.56 0.00 0.00 34.95 30.03 3dkw s ARG 110 CO 0.19 -1.28 0.89 -0.06 -0.81 0.00 0.00 175.30 174.23 3dkw s PHE 111 N -1.18 3.89 0.21 5.12 0.40 -0.91 -2.08 117.98 123.43 3dkw s PHE 111 Ca 0.25 1.77 -0.30 0.00 -0.60 0.00 0.00 56.93 58.06 3dkw s PHE 111 Cb -0.06 -2.94 -0.08 0.00 0.51 0.00 0.00 43.02 40.45 3dkw s PHE 111 CO -0.15 0.38 1.07 0.45 0.70 0.00 0.00 175.22 177.67 3dkw s SER 112 N -0.71 7.32 0.10 1.36 0.15 -1.26 -1.25 113.70 119.42 3dkw s SER 112 Ca 0.41 2.10 -0.15 0.00 0.70 0.00 0.00 55.95 59.02 3dkw s SER 112 Cb -0.24 -2.61 -0.08 0.00 -1.71 0.00 0.00 66.02 61.38 3dkw s SER 112 CO 0.29 -0.15 1.43 0.78 1.20 0.00 0.00 173.24 176.79 3dkw h ASN 113 N 4.69 0.76 0.32 5.45 2.35 -0.94 -2.75 115.58 125.45 3dkw h ASN 113 Ca -0.45 -0.47 -0.09 0.00 -0.55 0.00 0.00 56.30 54.75 3dkw h ASN 113 Cb 1.21 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 39.36 3dkw h ASN 113 CO 0.70 1.07 -0.38 0.11 -1.65 0.00 0.00 177.43 177.28 3dkw h LYS 114 N 0.46 0.09 -0.24 0.81 1.57 -1.94 -2.10 116.57 115.22 3dkw h LYS 114 Ca 0.05 -0.04 -0.19 0.00 -1.87 0.00 0.00 60.65 58.61 3dkw h LYS 114 Cb 0.85 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.15 3dkw h LYS 114 CO 0.07 0.46 -0.59 0.00 -0.57 0.00 0.00 179.45 178.82 3dkw h ALA 115 N 1.54 0.50 -0.06 3.86 0.00 -1.89 -2.07 119.26 121.15 3dkw h ALA 115 Ca 0.01 -0.53 -0.18 0.00 0.00 0.00 0.00 54.91 54.21 3dkw h ALA 115 Cb 0.71 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 3dkw h ALA 115 CO 0.05 0.69 -0.73 -0.92 0.00 0.00 0.00 179.25 178.34 3dkw h TYR 116 N 0.59 0.43 -0.26 0.00 3.20 -1.36 -1.47 116.97 118.11 3dkw h TYR 116 Ca 0.00 -0.19 -0.11 0.00 3.14 0.00 0.00 58.73 61.57 3dkw h TYR 116 Cb 1.18 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 39.37 3dkw h TYR 116 CO 0.07 0.94 -0.29 -0.07 -1.64 0.00 0.00 178.16 177.17 3dkw h LEU 117 N 0.21 0.54 -0.41 2.82 3.38 -1.36 -2.10 115.31 118.39 3dkw h LEU 117 Ca -0.03 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.74 3dkw h LEU 117 Cb 1.30 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.90 3dkw h LEU 117 CO 0.12 0.81 0.00 0.03 0.09 0.00 0.00 178.44 179.49 3dkw h ARG 118 N 0.46 0.00 0.01 1.13 3.08 -1.24 -2.44 114.38 115.37 3dkw h ARG 118 Ca 0.06 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.92 3dkw h ARG 118 Cb 0.74 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.77 3dkw h ARG 118 CO 0.06 0.00 -0.87 0.37 -1.07 0.00 0.00 179.97 178.46 3dkw h GLN 119 N 0.00 0.10 0.00 0.04 5.75 -0.62 -3.41 115.11 116.98 3dkw h GLN 119 Ca 0.00 -0.12 0.00 0.00 -0.15 0.00 0.00 58.65 58.38 3dkw h GLN 119 Cb 0.80 0.04 0.00 0.00 1.07 0.00 0.00 27.48 29.39 3dkw h GLN 119 CO 0.00 0.91 0.00 1.28 -2.65 0.00 0.00 178.83 178.37 3dkw n LEU 120 N -3.60 1.32 0.00 -2.39 4.77 -0.93 -4.90 117.00 111.27 3dkw n LEU 120 Ca -0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 3dkw n LEU 120 Cb 0.81 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.90 3dkw n LEU 120 CO 0.47 0.00 0.00 1.67 -1.33 0.00 0.00 177.39 178.20 3dkw n GLN 121 N -1.03 0.00 -1.82 3.23 7.27 -0.93 -4.67 117.38 119.43 3dkw n GLN 121 Ca 0.00 0.00 -0.29 0.00 0.07 0.00 0.00 57.00 56.78 3dkw n GLN 121 Cb 0.00 0.00 0.09 0.00 2.41 0.00 0.00 30.24 32.74 3dkw n GLN 121 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 3dkw s ASP 122 N -4.00 4.50 0.00 1.69 1.01 -1.26 -5.09 116.67 113.52 3dkw s ASP 122 Ca 0.00 0.90 0.00 0.00 0.71 0.00 0.00 52.55 54.16 3dkw s ASP 122 Cb 0.00 -1.47 0.00 0.00 1.01 0.00 0.00 42.92 42.46 3dkw s ASP 122 CO 0.00 -1.92 0.00 0.59 0.21 0.00 0.00 175.17 174.05 3dkw n ASN 123 N -3.34 0.00 -0.76 0.27 5.03 -1.26 -4.55 115.26 110.64 3dkw n ASN 123 Ca 0.08 0.00 0.10 0.00 0.87 0.00 0.00 54.58 55.62 3dkw n ASN 123 Cb 0.60 0.00 -0.04 0.00 -1.02 0.00 0.00 39.78 39.32 3dkw n ASN 123 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 3dkw n THR 124 N 0.00 -0.05 0.00 3.41 -2.24 -1.26 -3.20 114.28 110.94 3dkw n THR 124 Ca 0.00 0.28 0.00 0.00 -2.27 0.00 0.00 64.05 62.06 3dkw n THR 124 Cb 0.00 -0.54 0.00 0.00 -2.10 0.00 0.00 70.33 67.69 3dkw n THR 124 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 3dkw n PRO 125 N -3.44 0.00 0.13 -0.78 -0.02 -1.26 0.80 135.00 130.43 3dkw n PRO 125 Ca -0.02 0.12 0.05 0.00 -2.02 0.00 0.00 63.50 61.63 3dkw n PRO 125 Cb 0.36 -1.61 0.03 0.00 -0.02 0.00 0.00 33.50 32.26 3dkw n PRO 125 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3dkw h LEU 126 N 0.00 0.00 0.00 2.45 5.85 -1.92 -3.27 115.31 118.42 3dkw h LEU 126 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3dkw h LEU 126 Cb 0.22 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.25 3dkw h LEU 126 CO 0.00 0.35 -0.70 0.00 -0.34 0.00 0.00 178.44 177.76 3dkw n ALA 127 N -2.22 1.72 -0.08 1.25 0.00 0.24 -4.66 120.51 116.75 3dkw n ALA 127 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.37 3dkw n ALA 127 Cb 0.69 0.19 0.10 0.00 0.00 0.00 0.00 19.45 20.43 3dkw n ALA 127 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3dkw h LEU 128 N 0.00 0.77 -0.69 0.00 3.38 -0.83 -2.96 115.31 114.98 3dkw h LEU 128 Ca 0.00 -0.27 -0.06 0.00 0.09 0.00 0.00 57.88 57.64 3dkw h LEU 128 Cb 0.70 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 3dkw h LEU 128 CO 0.00 0.96 0.19 0.00 0.09 0.00 0.00 178.44 179.68 3dkw h ALA 129 N 1.10 0.90 -0.12 1.53 0.00 -1.74 -2.27 119.26 118.66 3dkw h ALA 129 Ca 0.10 -0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.79 3dkw h ALA 129 Cb 0.70 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 3dkw h ALA 129 CO 0.05 0.60 0.08 -0.07 0.00 0.00 0.00 179.25 179.92 3dkw h LEU 130 N 1.02 0.10 -0.64 0.00 3.38 -1.78 0.41 115.31 117.79 3dkw h LEU 130 Ca 0.22 -0.00 -0.14 0.00 0.09 0.00 0.00 57.88 58.05 3dkw h LEU 130 Cb 0.33 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 3dkw h LEU 130 CO -0.00 0.07 -0.65 -0.07 0.09 0.00 0.00 178.44 177.88 3dkw h LEU 131 N 0.11 0.00 0.07 1.67 3.38 -1.28 -2.77 115.31 116.49 3dkw h LEU 131 Ca 0.05 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.82 3dkw h LEU 131 Cb 0.05 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3dkw h LEU 131 CO -0.01 0.65 -1.03 0.00 0.09 0.00 0.00 178.44 178.14 3dkw h ALA 132 N 1.35 0.14 -0.52 1.53 0.00 -0.72 -3.03 119.26 118.01 3dkw h ALA 132 Ca -0.01 -0.96 0.00 0.00 0.00 0.00 0.00 54.91 53.95 3dkw h ALA 132 Cb 1.18 0.41 -0.03 0.00 0.00 0.00 0.00 17.79 19.36 3dkw h ALA 132 CO 0.08 0.58 0.34 0.87 0.00 0.00 0.00 179.25 181.13 3dkw h LYS 133 N -0.62 0.68 0.01 0.00 1.79 -0.37 -1.30 116.57 116.76 3dkw h LYS 133 Ca -0.24 -0.04 -0.19 0.00 -2.18 0.00 0.00 60.65 58.00 3dkw h LYS 133 Cb 1.48 -0.15 -0.02 0.00 -1.58 0.00 0.00 32.23 31.96 3dkw h LYS 133 CO -0.01 0.46 -0.89 1.25 -1.08 0.00 0.00 179.45 179.18 3dkw h LEU 134 N 0.70 0.16 -0.49 2.94 5.85 -1.63 -3.08 115.31 119.76 3dkw h LEU 134 Ca 0.19 -0.13 -0.15 0.00 0.84 0.00 0.00 57.88 58.63 3dkw h LEU 134 Cb -0.07 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 3dkw h LEU 134 CO -0.04 0.97 -0.38 -1.28 -0.34 0.00 0.00 178.44 177.36 3dkw h SER 135 N 0.06 0.88 -0.62 1.25 0.87 -1.23 -2.10 113.55 112.66 3dkw h SER 135 Ca -0.03 -0.40 -0.09 0.00 -1.23 0.00 0.00 61.79 60.04 3dkw h SER 135 Cb 1.54 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 63.23 3dkw h SER 135 CO 0.13 1.16 0.05 0.71 -0.53 0.00 0.00 176.83 178.35 3dkw h THR 136 N 0.68 1.26 0.00 2.23 1.35 -1.31 -2.44 112.91 114.68 3dkw h THR 136 Ca 0.06 -1.09 -0.11 0.00 -0.55 0.00 0.00 66.41 64.71 3dkw h THR 136 Cb 0.95 0.72 -0.02 0.00 -1.73 0.00 0.00 68.15 68.07 3dkw h THR 136 CO 0.09 0.40 -0.54 0.03 -0.25 0.00 0.00 175.52 175.26 3dkw h ARG 137 N 0.99 0.00 -0.01 4.72 3.08 -1.48 -2.89 114.38 118.79 3dkw h ARG 137 Ca 0.19 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.24 3dkw h ARG 137 Cb 0.50 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.55 3dkw h ARG 137 CO 0.02 0.54 0.00 -0.07 -1.07 0.00 0.00 179.97 179.39 3dkw h LEU 138 N 0.00 0.01 -1.49 3.04 3.38 -1.03 -1.58 115.31 117.64 3dkw h LEU 138 Ca -0.01 -0.28 0.02 0.00 0.09 0.00 0.00 57.88 57.71 3dkw h LEU 138 Cb 0.97 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.68 3dkw h LEU 138 CO 0.07 0.28 0.36 0.45 0.09 0.00 0.00 178.44 179.70 3dkw h HIS 139 N -0.27 0.64 -0.13 1.13 3.86 -1.44 0.42 115.15 119.37 3dkw h HIS 139 Ca 0.00 0.02 -0.08 0.00 -1.16 0.00 0.00 60.37 59.15 3dkw h HIS 139 Cb 0.28 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.52 3dkw h HIS 139 CO 0.02 0.39 -0.27 1.96 0.86 0.00 0.00 177.93 180.89 3dkw h GLN 140 N 0.68 0.24 0.04 2.45 4.20 -1.33 -1.72 115.11 119.67 3dkw h GLN 140 Ca 0.21 -0.08 -0.24 0.00 0.06 0.00 0.00 58.65 58.60 3dkw h GLN 140 Cb 0.02 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.78 3dkw h GLN 140 CO -0.05 0.50 -1.04 0.00 -0.67 0.00 0.00 178.83 177.57 3dkw h ARG 141 N 0.21 0.38 -0.43 1.46 3.08 0.15 -2.44 114.38 116.79 3dkw h ARG 141 Ca 0.03 -0.46 0.00 0.00 0.07 0.00 0.00 59.98 59.62 3dkw h ARG 141 Cb 0.60 0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.77 3dkw h ARG 141 CO 0.04 1.15 0.27 0.82 -1.07 0.00 0.00 179.97 181.18 3dkw h ILE 142 N 0.19 1.13 0.00 2.04 2.04 0.05 0.12 117.51 123.08 3dkw h ILE 142 Ca -0.10 -0.27 -0.06 0.00 1.00 0.00 0.00 64.86 65.43 3dkw h ILE 142 Cb 1.70 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 38.30 3dkw h ILE 142 CO 0.18 0.13 -0.28 0.44 0.00 0.00 0.00 178.15 178.61 3dkw h ASP 143 N 0.58 0.00 0.70 1.72 3.32 -1.37 0.04 116.42 121.41 3dkw h ASP 143 Ca 0.16 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 57.10 3dkw h ASP 143 Cb -0.03 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 3dkw h ASP 143 CO -0.03 0.28 -0.53 -0.08 -1.72 0.00 0.00 179.24 177.16 3dkw h GLU 144 N 0.00 0.00 0.15 3.56 4.57 -0.71 -2.64 114.58 119.50 3dkw h GLU 144 Ca -0.00 0.00 -0.24 0.00 -1.18 0.00 0.00 59.36 57.94 3dkw h GLU 144 Cb 0.55 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.15 3dkw h GLU 144 CO 0.04 0.53 -1.14 0.82 -1.18 0.00 0.00 179.01 178.07 3dkw h ILE 145 N 0.00 1.29 -0.23 2.32 2.04 -0.10 -2.83 117.51 120.00 3dkw h ILE 145 Ca -0.01 -2.50 -0.02 0.00 1.00 0.00 0.00 64.86 63.33 3dkw h ILE 145 Cb 1.02 2.99 -0.01 0.00 -0.74 0.00 0.00 36.82 40.08 3dkw h ILE 145 CO 0.07 0.72 0.06 -0.33 0.00 0.00 0.00 178.15 178.67 3dkw h GLU 146 N -0.28 0.32 0.00 2.37 5.08 -1.03 0.79 114.58 121.83 3dkw h GLU 146 Ca -0.22 -0.04 -0.11 0.00 -1.00 0.00 0.00 59.36 57.98 3dkw h GLU 146 Cb 1.76 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.93 3dkw h GLU 146 CO 0.13 0.30 -0.62 1.79 -1.00 0.00 0.00 179.01 179.60 3dkw h THR 147 N 0.32 1.35 -0.37 1.13 1.35 -1.59 -3.20 112.91 111.89 3dkw h THR 147 Ca 0.08 -2.25 -0.12 0.00 -0.55 0.00 0.00 66.41 63.57 3dkw h THR 147 Cb 0.12 2.78 -0.01 0.00 -1.73 0.00 0.00 68.15 69.32 3dkw h THR 147 CO -0.00 0.46 -0.24 -0.07 -0.25 0.00 0.00 175.52 175.41 3dkw h LEU 148 N -1.00 0.86 -1.15 3.87 3.38 -1.49 0.29 115.31 120.07 3dkw h LEU 148 Ca -0.17 -0.43 -0.02 0.00 0.09 0.00 0.00 57.88 57.35 3dkw h LEU 148 Cb 1.14 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.62 3dkw h LEU 148 CO -0.10 1.10 0.35 0.77 0.09 0.00 0.00 178.44 180.65 3dkw h SER 149 N 0.62 0.84 0.09 -0.43 4.64 -1.02 -0.57 113.55 117.72 3dkw h SER 149 Ca 0.08 -0.07 -0.20 0.00 -0.47 0.00 0.00 61.79 61.12 3dkw h SER 149 Cb 0.80 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 3dkw h SER 149 CO 0.07 0.69 -0.75 -0.07 -0.87 0.00 0.00 176.83 175.90 3dkw h LEU 150 N 0.94 0.67 -1.40 5.97 3.38 -1.52 -2.72 115.31 120.64 3dkw h LEU 150 Ca 0.24 -0.44 0.03 0.00 0.09 0.00 0.00 57.88 57.80 3dkw h LEU 150 Cb 0.05 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.57 3dkw h LEU 150 CO -0.04 1.20 0.43 0.11 0.09 0.00 0.00 178.44 180.24 3dkw h LYS 151 N 0.38 0.77 0.00 1.13 1.57 -0.17 0.21 116.57 120.47 3dkw h LYS 151 Ca -0.04 -0.05 -0.07 0.00 -1.87 0.00 0.00 60.65 58.62 3dkw h LYS 151 Cb 1.34 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 33.47 3dkw h LYS 151 CO 0.14 0.51 -0.34 -0.97 -0.57 0.00 0.00 179.45 178.22 3dkw h ASN 152 N 0.79 0.00 0.45 0.86 -1.24 -1.01 -1.73 115.58 113.70 3dkw h ASN 152 Ca 0.26 0.00 -0.26 0.00 0.71 0.00 0.00 56.30 57.01 3dkw h ASN 152 Cb 0.05 0.00 0.01 0.00 0.73 0.00 0.00 38.32 39.11 3dkw h ASN 152 CO -0.07 0.34 -1.12 0.00 -1.29 0.00 0.00 177.43 175.29 3dkw h ALA 153 N 1.66 0.20 0.00 1.57 0.00 -0.48 -2.41 119.26 119.81 3dkw h ALA 153 Ca -0.00 -0.80 -0.11 0.00 0.00 0.00 0.00 54.91 54.00 3dkw h ALA 153 Cb 0.83 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 3dkw h ALA 153 CO 0.04 0.87 -0.51 1.79 0.00 0.00 0.00 179.25 181.44 3dkw h THR 154 N 0.16 1.11 -0.03 0.00 1.35 -0.58 -2.82 112.91 112.10 3dkw h THR 154 Ca -0.12 -1.93 -0.19 0.00 -0.55 0.00 0.00 66.41 63.62 3dkw h THR 154 Cb 1.80 2.12 0.01 0.00 -1.73 0.00 0.00 68.15 70.35 3dkw h THR 154 CO 0.19 0.50 -0.71 0.45 -0.25 0.00 0.00 175.52 175.71 3dkw h HIS 155 N 0.00 0.77 -0.03 4.73 -0.00 -1.33 -3.14 115.15 116.15 3dkw h HIS 155 Ca -0.01 -0.40 -0.12 0.00 -0.00 0.00 0.00 60.37 59.85 3dkw h HIS 155 Cb 1.08 -0.10 -0.01 0.00 -0.00 0.00 0.00 27.41 28.38 3dkw h HIS 155 CO 0.00 1.21 -0.52 -0.09 -0.00 0.00 0.00 177.93 178.53 3dkw h ARG 156 N 0.11 0.09 -0.03 2.45 2.43 -1.43 -2.71 114.38 115.30 3dkw h ARG 156 Ca -0.08 -0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 58.96 3dkw h ARG 156 Cb 1.39 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.94 3dkw h ARG 156 CO 0.14 0.59 -0.29 -0.24 -1.51 0.00 0.00 179.97 178.66 3dkw h VAL 157 N 0.07 1.48 -0.23 0.20 3.04 -1.60 -3.16 116.25 116.05 3dkw h VAL 157 Ca -0.00 -1.82 -0.04 0.00 -1.01 0.00 0.00 66.70 63.83 3dkw h VAL 157 Cb 0.95 2.53 -0.01 0.00 -2.01 0.00 0.00 31.29 32.74 3dkw h VAL 157 CO 0.07 0.51 -0.05 0.58 -1.01 0.00 0.00 177.57 177.68 3dkw h VAL 158 N -0.32 1.17 0.00 1.51 2.07 -1.56 -2.04 116.25 117.07 3dkw h VAL 158 Ca -0.03 -0.70 -0.01 0.00 0.82 0.00 0.00 66.70 66.78 3dkw h VAL 158 Cb 0.99 1.05 -0.00 0.00 -1.52 0.00 0.00 31.29 31.81 3dkw h VAL 158 CO 0.06 0.23 -0.03 0.03 0.02 0.00 0.00 177.57 177.88 3dkw h ARG 159 N 0.34 0.00 0.00 1.57 3.08 -1.52 -2.62 114.38 115.23 3dkw h ARG 159 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.12 3dkw h ARG 159 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.36 3dkw h ARG 159 CO 0.01 0.03 -0.87 0.98 -1.07 0.00 0.00 179.97 179.06 3dkw n TYR 160 N -3.14 0.05 0.08 3.04 4.19 -0.80 -3.82 117.16 116.77 3dkw n TYR 160 Ca 0.01 0.01 -0.22 0.00 3.31 0.00 0.00 57.90 61.01 3dkw n TYR 160 Cb 0.32 -0.18 -0.14 0.00 0.49 0.00 0.00 39.34 39.83 3dkw n TYR 160 CO 0.00 0.00 0.00 -0.07 0.91 0.00 0.00 176.86 177.70 3dkw h LEU 161 N 0.00 0.71 -0.28 2.98 3.38 -1.12 -3.22 115.31 117.76 3dkw h LEU 161 Ca 0.00 -0.88 -0.18 0.00 0.09 0.00 0.00 57.88 56.90 3dkw h LEU 161 Cb 0.56 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 3dkw h LEU 161 CO 0.00 1.53 -0.87 -0.07 0.09 0.00 0.00 178.44 179.12 3dkw h LEU 162 N -0.01 0.05 -1.18 1.67 3.38 -1.73 -3.23 115.31 114.27 3dkw h LEU 162 Ca -0.18 -0.04 -0.08 0.00 0.09 0.00 0.00 57.88 57.67 3dkw h LEU 162 Cb 1.83 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 42.55 3dkw h LEU 162 CO 0.21 0.89 -0.32 0.71 0.09 0.00 0.00 178.44 180.02 3dkw h THR 163 N 0.02 1.26 0.00 0.22 1.35 -1.68 -2.07 112.91 112.01 3dkw h THR 163 Ca -0.02 -1.22 0.00 0.00 -0.55 0.00 0.00 66.41 64.62 3dkw h THR 163 Cb 1.53 1.55 0.00 0.00 -1.73 0.00 0.00 68.15 69.49 3dkw h THR 163 CO 0.12 0.36 0.00 0.18 -0.25 0.00 0.00 175.52 175.93 3dkw n LEU 164 N -4.12 0.64 0.09 3.87 4.77 -1.22 -3.08 117.00 117.95 3dkw n LEU 164 Ca -0.01 0.57 -0.06 0.00 -0.03 0.00 0.00 56.01 56.48 3dkw n LEU 164 Cb 0.39 -0.39 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 3dkw n LEU 164 CO 0.40 -0.20 0.28 0.00 -1.33 0.00 0.00 177.39 176.53 3dkw h ALA 165 N 2.57 0.59 0.24 -1.18 0.00 -1.41 -3.34 119.26 116.73 3dkw h ALA 165 Ca 0.00 -0.75 -0.01 0.00 0.00 0.00 0.00 54.91 54.15 3dkw h ALA 165 Cb 0.64 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.32 3dkw h ALA 165 CO 0.00 1.00 -0.12 0.00 0.00 0.00 0.00 179.25 180.14 3dkw h ALA 166 N 1.10 -0.32 -2.53 0.00 0.00 -1.52 -3.41 119.26 112.58 3dkw h ALA 166 Ca -0.02 -0.15 -0.50 0.00 0.00 0.00 0.00 54.91 54.24 3dkw h ALA 166 Cb 1.49 0.13 0.06 0.00 0.00 0.00 0.00 17.79 19.47 3dkw h ALA 166 CO 0.12 -0.34 0.42 -1.01 0.00 0.00 0.00 179.25 178.44 3dkw s HIS 167 N -3.07 2.74 0.23 0.00 4.02 -1.21 -4.80 115.29 113.20 3dkw s HIS 167 Ca -0.09 1.55 0.00 0.00 1.02 0.00 0.00 55.06 57.54 3dkw s HIS 167 Cb 0.00 -3.23 0.00 0.00 -1.02 0.00 0.00 32.58 28.33 3dkw s HIS 167 CO 0.31 -1.42 0.00 0.00 1.02 0.00 0.00 174.74 174.65 3dkw n ALA 168 N -1.30 -2.25 -1.00 -1.40 0.00 -1.26 -4.83 120.51 108.47 3dkw n ALA 168 Ca 0.11 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.92 3dkw n ALA 168 Cb 0.51 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.71 3dkw n ALA 168 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3dkw n PRO 169 N 0.90 1.41 -1.17 0.00 -0.04 -1.26 -4.91 135.00 129.93 3dkw n PRO 169 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 3dkw n PRO 169 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 3dkw n PRO 169 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3dkw n GLY 170 N 4.39 0.83 0.00 0.55 0.00 -1.26 -4.99 105.19 104.71 3dkw n GLY 170 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.61 3dkw n GLY 170 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3dkw n GLU 171 N -1.03 0.00 -2.29 1.61 1.02 -1.26 -4.95 120.64 113.73 3dkw n GLU 171 Ca 0.00 0.00 -0.20 0.00 -0.02 0.00 0.00 57.16 56.94 3dkw n GLU 171 Cb 0.37 0.00 0.10 0.00 -0.02 0.00 0.00 31.44 31.89 3dkw n GLU 171 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3dkw n ASN 172 N -1.41 1.16 -3.59 1.62 4.13 -1.26 -4.50 115.26 111.42 3dkw n ASN 172 Ca 0.00 -1.98 -0.22 0.00 1.68 0.00 0.00 54.58 54.06 3dkw n ASN 172 Cb 0.00 -0.55 0.05 0.00 -1.54 0.00 0.00 39.78 37.73 3dkw n ASN 172 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3dkw s ARG 174 N -5.62 0.57 0.13 0.00 1.81 -1.26 -1.62 118.95 112.96 3dkw s ARG 174 Ca 0.19 -0.37 -0.23 0.00 -1.72 0.00 0.00 55.73 53.60 3dkw s ARG 174 Cb -0.05 -0.52 -0.07 0.00 -0.45 0.00 0.00 34.95 33.86 3dkw s ARG 174 CO 0.80 0.13 0.70 0.08 -0.68 0.00 0.00 175.30 176.33 3dkw s VAL 175 N -0.42 4.52 0.00 3.52 1.01 0.54 -3.76 120.40 125.82 3dkw s VAL 175 Ca 0.00 1.51 0.00 0.00 0.00 0.00 0.00 61.98 63.50 3dkw s VAL 175 Cb -0.04 -4.05 0.00 0.00 0.00 0.00 0.00 36.38 32.29 3dkw s VAL 175 CO -0.00 0.53 0.00 -0.62 0.00 0.00 0.00 175.10 175.01 3dkw n GLU 176 N 1.68 3.39 -2.32 2.72 1.02 -1.26 -3.84 120.64 122.01 3dkw n GLU 176 Ca -0.07 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.06 3dkw n GLU 176 Cb 0.49 0.00 -0.01 0.00 -0.02 0.00 0.00 31.44 31.91 3dkw n GLU 176 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 3dkw n ILE 177 N 0.00 -9.25 0.33 -3.67 5.41 -1.26 -4.79 119.36 106.13 3dkw n ILE 177 Ca 0.00 1.46 0.13 0.00 1.00 0.00 0.00 62.75 65.34 3dkw n ILE 177 Cb 0.00 -5.95 0.58 0.00 -0.71 0.00 0.00 39.64 33.55 3dkw n ILE 177 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 3dkw h PRO 178 N 2.30 0.00 -7.12 0.38 0.11 -1.94 -3.45 132.00 122.28 3dkw h PRO 178 Ca -0.10 0.00 -0.50 0.00 0.11 0.00 0.00 66.00 65.51 3dkw h PRO 178 Cb 0.22 0.00 0.08 0.00 0.11 0.00 0.00 31.00 31.41 3dkw h PRO 178 CO 0.05 0.00 0.41 0.08 -0.21 0.00 0.00 178.00 178.33 3dkw s VAL 179 N -3.46 3.27 0.83 3.15 1.01 -1.26 -4.68 120.40 119.25 3dkw s VAL 179 Ca 0.02 0.72 -0.14 0.00 0.00 0.00 0.00 61.98 62.58 3dkw s VAL 179 Cb 0.09 -3.26 0.02 0.00 0.00 0.00 0.00 36.38 33.23 3dkw s VAL 179 CO 0.37 -0.23 0.66 0.00 0.00 0.00 0.00 175.10 175.89 3dkw n ALA 180 N -1.61 -1.53 0.19 5.51 0.00 -1.26 -4.87 120.51 116.94 3dkw n ALA 180 Ca 0.11 -0.40 0.04 0.00 0.00 0.00 0.00 53.44 53.19 3dkw n ALA 180 Cb 0.51 -1.93 0.39 0.00 0.00 0.00 0.00 19.45 18.42 3dkw n ALA 180 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3dkw h LYS 181 N -0.95 0.00 -0.11 0.00 1.57 -1.93 -2.74 116.57 112.40 3dkw h LYS 181 Ca -0.45 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.29 3dkw h LYS 181 Cb 1.31 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.61 3dkw h LYS 181 CO 0.40 0.36 -0.12 1.96 -0.57 0.00 0.00 179.45 181.48 3dkw h GLN 182 N 0.00 0.17 0.00 3.15 4.20 -1.96 -1.93 115.11 118.74 3dkw h GLN 182 Ca -0.00 -0.04 -0.11 0.00 0.06 0.00 0.00 58.65 58.57 3dkw h GLN 182 Cb 0.69 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.43 3dkw h GLN 182 CO 0.05 0.31 -0.50 -0.07 -0.67 0.00 0.00 178.83 177.94 3dkw h LEU 183 N 0.17 0.00 -2.11 1.46 3.38 -1.84 -3.13 115.31 113.23 3dkw h LEU 183 Ca 0.04 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 3dkw h LEU 183 Cb 0.33 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 3dkw h LEU 183 CO 0.02 0.50 -0.08 0.58 0.09 0.00 0.00 178.44 179.55 3dkw h VAL 184 N 0.00 0.49 -0.28 1.22 2.07 -1.27 -1.47 116.25 117.01 3dkw h VAL 184 Ca -0.01 -0.36 -0.09 0.00 0.82 0.00 0.00 66.70 67.06 3dkw h VAL 184 Cb 1.34 1.24 -0.01 0.00 -1.52 0.00 0.00 31.29 32.34 3dkw h VAL 184 CO 0.07 0.08 -0.19 0.00 0.02 0.00 0.00 177.57 177.55 3dkw h ALA 185 N 1.92 0.40 0.00 1.67 0.00 -1.51 -2.71 119.26 119.03 3dkw h ALA 185 Ca -0.00 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3dkw h ALA 185 Cb 0.24 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3dkw h ALA 185 CO 0.01 0.32 0.00 0.41 0.00 0.00 0.00 179.25 179.99 3dkw n GLY 186 N 0.05 -1.38 0.18 0.00 0.00 -0.77 -2.84 105.19 100.43 3dkw n GLY 186 Ca -0.04 0.02 -0.00 0.00 0.00 0.00 0.00 46.02 46.00 3dkw n GLY 186 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3dkw h HIS 187 N 0.00 0.13 0.00 1.61 2.76 -0.96 -3.42 115.15 115.28 3dkw h HIS 187 Ca 0.00 -0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.13 3dkw h HIS 187 Cb 0.46 -0.03 0.00 0.00 1.55 0.00 0.00 27.41 29.39 3dkw h HIS 187 CO 0.00 0.53 0.00 1.28 -1.30 0.00 0.00 177.93 178.44 3dkw n LEU 188 N -4.01 0.00 0.00 0.26 4.77 -1.13 -5.06 117.00 111.82 3dkw n LEU 188 Ca -0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 3dkw n LEU 188 Cb 0.48 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 3dkw n LEU 188 CO 0.41 0.00 0.00 -1.54 -1.33 0.00 0.00 177.39 174.93 3dkw n SER 189 N 0.00 0.00 -4.76 -1.43 3.41 -1.18 -5.12 113.62 104.54 3dkw n SER 189 Ca 0.00 -0.25 -0.39 0.00 -0.26 0.00 0.00 58.87 57.96 3dkw n SER 189 Cb 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 63.90 3dkw n SER 189 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3dkw s ILE 190 N 0.00 3.70 0.31 -1.33 1.01 -1.19 -5.01 121.20 118.69 3dkw s ILE 190 Ca 0.00 1.58 -0.29 0.00 0.00 0.00 0.00 60.65 61.94 3dkw s ILE 190 Cb 0.00 -3.95 -0.10 0.00 0.01 0.00 0.00 42.46 38.42 3dkw s ILE 190 CO 0.00 0.28 1.18 -1.10 0.00 0.00 0.00 174.94 175.30 3dkw s GLN 191 N -1.71 4.50 0.44 2.79 -0.21 -1.26 -4.18 119.66 120.03 3dkw s GLN 191 Ca 0.48 1.97 0.18 0.00 0.02 0.00 0.00 55.36 58.01 3dkw s GLN 191 Cb -0.27 -3.12 1.13 0.00 1.00 0.00 0.00 33.01 31.74 3dkw s GLN 191 CO 0.35 0.03 1.90 -1.35 -2.12 0.00 0.00 175.29 174.10 3dkw h PRO 192 N 3.58 0.34 -0.14 2.91 0.11 -1.89 0.46 132.00 137.37 3dkw h PRO 192 Ca -0.48 -0.02 -0.15 0.00 0.11 0.00 0.00 66.00 65.46 3dkw h PRO 192 Cb 1.22 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 3dkw h PRO 192 CO 0.66 0.22 -0.54 0.93 -0.21 0.00 0.00 178.00 179.06 3dkw h GLU 193 N 0.35 0.42 0.00 1.05 5.08 -1.97 -2.90 114.58 116.61 3dkw h GLU 193 Ca 0.40 -0.26 -0.12 0.00 -1.00 0.00 0.00 59.36 58.38 3dkw h GLU 193 Cb 1.05 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.31 3dkw h GLU 193 CO -0.12 0.86 -1.35 0.25 -1.00 0.00 0.00 179.01 177.64 3dkw n THR 194 N -3.94 1.01 0.04 1.13 -2.24 -0.20 -3.93 114.28 106.15 3dkw n THR 194 Ca -0.03 -0.65 -0.07 0.00 -2.27 0.00 0.00 64.05 61.03 3dkw n THR 194 Cb 0.59 -0.61 0.09 0.00 -2.10 0.00 0.00 70.33 68.30 3dkw n THR 194 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 3dkw h PHE 195 N 0.00 0.53 -0.16 4.78 3.57 -0.16 -3.05 116.94 122.45 3dkw h PHE 195 Ca -0.13 -0.19 -0.12 0.00 3.53 0.00 0.00 57.97 61.06 3dkw h PHE 195 Cb 1.43 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 40.06 3dkw h PHE 195 CO 0.00 0.89 -0.42 1.03 -2.23 0.00 0.00 178.31 177.58 3dkw h SER 196 N 0.32 0.40 -0.48 0.41 0.87 -1.66 -2.92 113.55 110.50 3dkw h SER 196 Ca 0.00 -0.17 -0.01 0.00 -1.23 0.00 0.00 61.79 60.38 3dkw h SER 196 Cb 1.08 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 62.91 3dkw h SER 196 CO 0.10 0.77 0.28 0.03 -0.53 0.00 0.00 176.83 177.48 3dkw h ARG 197 N 0.31 0.68 -0.21 2.24 3.08 -1.65 -1.72 114.38 117.11 3dkw h ARG 197 Ca 0.03 -0.06 -0.12 0.00 0.07 0.00 0.00 59.98 59.89 3dkw h ARG 197 Cb 0.87 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.77 3dkw h ARG 197 CO 0.07 0.50 -0.39 0.82 -1.07 0.00 0.00 179.97 179.91 3dkw h ILE 198 N 0.69 1.30 0.00 2.04 2.04 -1.50 -2.20 117.51 119.88 3dkw h ILE 198 Ca 0.18 -1.52 -0.11 0.00 1.00 0.00 0.00 64.86 64.41 3dkw h ILE 198 Cb 0.01 1.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.64 3dkw h ILE 198 CO -0.03 0.47 -0.51 0.24 0.00 0.00 0.00 178.15 178.32 3dkw h MET 199 N 0.39 0.00 0.00 2.37 2.86 -1.28 -2.59 114.93 116.68 3dkw h MET 199 Ca 0.04 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 3dkw h MET 199 Cb 0.85 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.51 3dkw h MET 199 CO 0.07 0.51 -0.05 0.45 1.06 0.00 0.00 176.91 178.95 3dkw h HIS 200 N 0.00 0.00 0.10 -0.22 3.86 -1.11 -2.29 115.15 115.49 3dkw h HIS 200 Ca -0.01 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.20 3dkw h HIS 200 Cb 0.92 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.40 3dkw h HIS 200 CO 0.00 0.00 -0.05 0.00 0.86 0.00 0.00 177.93 178.74 3dkw h ARG 201 N 0.00 -0.12 0.00 2.45 3.08 -1.00 -2.98 114.38 115.81 3dkw h ARG 201 Ca 0.00 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.06 3dkw h ARG 201 Cb 0.86 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.94 3dkw h ARG 201 CO 0.00 -0.08 0.00 1.47 -1.07 0.00 0.00 179.97 180.29 3dkw n LEU 202 N -3.12 0.00 -0.00 3.04 -0.00 -1.14 -2.66 117.00 113.12 3dkw n LEU 202 Ca -0.02 0.00 -0.20 0.00 -0.00 0.00 0.00 56.01 55.79 3dkw n LEU 202 Cb 0.05 0.00 -0.14 0.00 -0.00 0.00 0.00 43.42 43.33 3dkw n LEU 202 CO 0.04 0.00 -0.81 0.61 -0.00 0.00 0.00 177.39 177.22 3dkw n GLY 203 N 0.84 -0.58 0.13 1.47 0.00 -0.86 -3.16 105.19 103.02 3dkw n GLY 203 Ca 0.18 -0.26 0.12 0.00 0.00 0.00 0.00 46.02 46.05 3dkw n GLY 203 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3dkw h ASP 204 N 0.06 0.00 0.61 1.61 5.19 -1.50 -3.30 116.42 119.09 3dkw h ASP 204 Ca -0.42 -0.06 -0.12 0.00 -0.62 0.00 0.00 57.03 55.81 3dkw h ASP 204 Cb 2.03 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 41.52 3dkw h ASP 204 CO 0.08 0.03 -0.59 -0.33 -3.12 0.00 0.00 179.24 175.31 3dkw h GLU 205 N 0.00 0.00 0.00 3.56 5.08 -1.67 -3.48 114.58 118.08 3dkw h GLU 205 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3dkw h GLU 205 Cb 0.89 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.14 3dkw h GLU 205 CO 0.00 0.59 0.00 0.41 -1.00 0.00 0.00 179.01 179.01 3dkw n GLY 206 N 0.19 0.79 0.29 -3.84 0.00 -1.24 -5.07 105.19 96.31 3dkw n GLY 206 Ca -0.01 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.21 3dkw n GLY 206 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3dkw n ILE 207 N 0.00 0.00 -3.74 -0.61 5.41 -1.19 -4.67 119.36 114.56 3dkw n ILE 207 Ca 0.00 0.00 -0.03 0.00 1.00 0.00 0.00 62.75 63.72 3dkw n ILE 207 Cb 0.00 -0.23 0.02 0.00 -0.71 0.00 0.00 39.64 38.72 3dkw n ILE 207 CO 0.00 0.00 0.00 2.30 0.00 0.00 0.00 176.55 178.85 3dkw n ILE 208 N -1.89 0.00 0.00 1.39 -6.64 -1.23 -2.64 119.36 108.35 3dkw n ILE 208 Ca 0.00 -0.51 0.00 0.00 -1.77 0.00 0.00 62.75 60.47 3dkw n ILE 208 Cb 0.12 0.63 0.00 0.00 -1.44 0.00 0.00 39.64 38.95 3dkw n ILE 208 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 3dkw n HIS 209 N -0.51 0.00 0.00 4.28 1.44 -1.26 -4.21 115.22 114.96 3dkw n HIS 209 Ca -0.03 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.68 3dkw n HIS 209 Cb 0.44 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.55 3dkw n HIS 209 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 3dkw n LEU 210 N 0.00 0.00 0.00 2.39 4.32 -1.26 -4.50 117.00 117.95 3dkw n LEU 210 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 3dkw n LEU 210 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 3dkw n LEU 210 CO 0.00 0.00 0.00 -0.67 -1.22 0.00 0.00 177.39 175.50 3dkw n ASP 211 N 0.00 0.00 -4.90 -1.43 -0.08 -1.26 -4.62 116.55 104.26 3dkw n ASP 211 Ca 0.00 0.00 -0.30 0.00 -1.51 0.00 0.00 54.79 52.98 3dkw n ASP 211 Cb 0.00 0.00 -0.04 0.00 2.34 0.00 0.00 41.12 43.42 3dkw n ASP 211 CO 0.00 0.00 0.00 -0.83 0.12 0.00 0.00 177.20 176.49 3dkw s GLY 212 N 0.00 2.00 -0.19 0.27 0.00 -1.26 -4.30 107.32 103.84 3dkw s GLY 212 Ca 0.00 -0.50 -0.02 0.00 0.00 0.00 0.00 44.72 44.20 3dkw s GLY 212 CO 0.00 -0.39 0.06 0.54 0.00 0.00 0.00 173.10 173.31 3dkw n ARG 213 N -0.61 -2.17 0.00 2.90 1.74 -1.26 -4.64 116.66 112.62 3dkw n ARG 213 Ca -0.01 0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 3dkw n ARG 213 Cb 0.53 -3.18 0.00 0.00 -1.02 0.00 0.00 32.46 28.80 3dkw n ARG 213 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 3dkw n GLU 214 N -1.93 0.00 -2.93 5.56 2.13 -1.26 -4.78 120.64 117.42 3dkw n GLU 214 Ca 0.01 0.00 -0.41 0.00 0.66 0.00 0.00 57.16 57.43 3dkw n GLU 214 Cb 0.35 0.00 -0.04 0.00 0.27 0.00 0.00 31.44 32.01 3dkw n GLU 214 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 3dkw s ILE 215 N 0.00 4.97 -0.20 6.31 1.01 -1.25 -4.68 121.20 127.35 3dkw s ILE 215 Ca 0.00 1.62 -0.09 0.00 0.00 0.00 0.00 60.65 62.18 3dkw s ILE 215 Cb 0.00 -4.12 -0.05 0.00 0.01 0.00 0.00 42.46 38.30 3dkw s ILE 215 CO 0.00 0.17 0.11 -0.44 0.00 0.00 0.00 174.94 174.78 3dkw s SER 216 N 0.94 5.95 -0.59 3.58 0.01 -1.26 -0.34 113.70 121.99 3dkw s SER 216 Ca 0.41 0.15 -0.18 0.00 1.31 0.00 0.00 55.95 57.64 3dkw s SER 216 Cb -0.18 -2.04 0.11 0.00 0.21 0.00 0.00 66.02 64.12 3dkw s SER 216 CO 0.19 0.16 0.65 -0.63 0.41 0.00 0.00 173.24 174.02 3dkw s ILE 217 N 0.48 4.96 -0.19 1.44 1.01 -0.64 -4.31 121.20 123.95 3dkw s ILE 217 Ca 0.06 -1.19 -0.20 0.00 0.00 0.00 0.00 60.65 59.32 3dkw s ILE 217 Cb -0.12 -4.45 -0.21 0.00 0.01 0.00 0.00 42.46 37.69 3dkw s ILE 217 CO -0.00 -1.05 0.29 -0.07 0.00 0.00 0.00 174.94 174.10 3dkw h LEU 218 N 9.60 0.08 -9.50 2.97 3.38 -1.78 -3.45 115.31 116.61 3dkw h LEU 218 Ca -0.28 -0.61 -0.62 0.00 0.09 0.00 0.00 57.88 56.45 3dkw h LEU 218 Cb 1.09 -0.03 -0.08 0.00 0.09 0.00 0.00 40.66 41.73 3dkw h LEU 218 CO 1.08 1.52 -0.36 -1.81 0.09 0.00 0.00 178.44 178.96 3dkw s ASP 219 N -6.86 6.50 0.00 -0.43 1.01 -1.20 -5.06 116.67 110.63 3dkw s ASP 219 Ca -0.27 0.59 0.00 0.00 0.71 0.00 0.00 52.55 53.58 3dkw s ASP 219 Cb 0.05 -2.16 0.00 0.00 1.01 0.00 0.00 42.92 41.83 3dkw s ASP 219 CO 0.63 0.26 0.00 -2.11 0.21 0.00 0.00 175.17 174.16 3dkw n ARG 220 N 2.62 0.11 0.00 8.23 1.85 -1.26 -4.81 116.66 123.41 3dkw n ARG 220 Ca -0.15 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.70 3dkw n ARG 220 Cb 0.53 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.94 3dkw n ARG 220 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 3dkw n GLU 221 N 0.00 0.00 -0.09 2.89 1.02 -1.26 -3.97 120.64 119.23 3dkw n GLU 221 Ca 0.00 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.02 3dkw n GLU 221 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 31.44 31.38 3dkw n GLU 221 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3dkw h ARG 222 N 0.00 0.60 0.00 3.49 3.08 -2.00 -2.13 114.38 117.41 3dkw h ARG 222 Ca 0.00 -0.28 -0.03 0.00 0.07 0.00 0.00 59.98 59.74 3dkw h ARG 222 Cb 0.00 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.04 3dkw h ARG 222 CO 0.00 0.86 -0.15 1.25 -1.07 0.00 0.00 179.97 180.86 3dkw h LEU 223 N 0.33 0.00 -0.55 3.04 5.85 -1.88 -2.91 115.31 119.19 3dkw h LEU 223 Ca 0.05 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.68 3dkw h LEU 223 Cb 0.71 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.73 3dkw h LEU 223 CO 0.05 0.15 -0.44 -0.08 -0.34 0.00 0.00 178.44 177.78 3dkw h GLU 224 N 0.00 0.00 -0.05 1.25 4.81 -1.79 -2.50 114.58 116.31 3dkw h GLU 224 Ca -0.00 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.10 3dkw h GLU 224 Cb 0.82 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.19 3dkw h GLU 224 CO 0.02 0.44 -0.56 0.00 -0.73 0.00 0.00 179.01 178.17 3dkw h PHE 226 N 0.11 0.63 0.00 0.00 0.04 -1.59 -3.52 116.94 112.61 3dkw h PHE 226 Ca -0.00 -0.44 0.00 0.00 2.80 0.00 0.00 57.97 60.33 3dkw h PHE 226 Cb 1.03 -0.04 0.00 0.00 2.20 0.00 0.00 35.95 39.14 3dkw h PHE 226 CO 0.01 1.32 0.00 -1.91 -0.60 0.00 0.00 178.31 177.13